 Entering Gaussian System, Link 0=g16
 Input=27_methylindane_Boat_STD_B3LYPDBJ-augccpVDZr.in
 Output=27_methylindane_Boat_STD_B3LYPDBJ-augccpVDZr.log
 AtFile(1): /user/pierpa/basis_sets/augccpVDZ.gbs
            -H     0
            S    4   1.00
                  1.301000D+01           1.968500D-02
                  1.962000D+00           1.379770D-01
                  4.446000D-01           4.781480D-01
                  1.220000D-01           5.012400D-01
            S    1   1.00
                  1.220000D-01           1.000000D+00
            S    1   1.00
                  0.0297400              1.0000000
            P    1   1.00
                  7.270000D-01           1.0000000
            P    1   1.00
                  0.1410000              1.0000000
            ****
            -He     0
            S    4   1.00
                  3.836000D+01           2.380900D-02
                  5.770000D+00           1.548910D-01
                  1.240000D+00           4.699870D-01
                  2.976000D-01           5.130270D-01
            S    1   1.00
                  2.976000D-01           1.000000D+00
            S    1   1.00
                  0.0725500              1.0000000
            P    1   1.00
                  1.275000D+00           1.0000000
            P    1   1.00
                  0.2473000              1.0000000
            ****
            -Li     0
            S    9   1.00
                  1.469000D+03           7.660000D-04
                  2.205000D+02           5.892000D-03
                  5.026000D+01           2.967100D-02
                  1.424000D+01           1.091800D-01
                  4.581000D+00           2.827890D-01
                  1.580000D+00           4.531230D-01
                  5.640000D-01           2.747740D-01
                  7.345000D-02           9.751000D-03
                  2.805000D-02          -3.180000D-03
            S    9   1.00
                  1.469000D+03          -1.200000D-04
                  2.205000D+02          -9.230000D-04
                  5.026000D+01          -4.689000D-03
                  1.424000D+01          -1.768200D-02
                  4.581000D+00          -4.890200D-02
                  1.580000D+00          -9.600900D-02
                  5.640000D-01          -1.363800D-01
                  7.345000D-02           5.751020D-01
                  2.805000D-02           5.176610D-01
            S    1   1.00
                  2.805000D-02           1.000000D+00
            S    1   1.00
                  8.600000D-03           1.000000D+00
            P    4   1.00
                  1.534000D+00           2.278400D-02
                  2.749000D-01           1.391070D-01
                  7.362000D-02           5.003750D-01
                  2.403000D-02           5.084740D-01
            P    1   1.00
                  2.403000D-02           1.000000D+00
            P    1   1.00
                  5.800000D-03           1.000000D+00
            D    1   1.00
                  1.144000D-01           1.0000000
            D    1   1.00
                  7.330000D-02           1.000000D+00
            ****
            -Be     0
            S    9   1.00
                  2.940000D+03           6.800000D-04
                  4.412000D+02           5.236000D-03
                  1.005000D+02           2.660600D-02
                  2.843000D+01           9.999300D-02
                  9.169000D+00           2.697020D-01
                  3.196000D+00           4.514690D-01
                  1.159000D+00           2.950740D-01
                  1.811000D-01           1.258700D-02
                  5.890000D-02          -3.756000D-03
            S    9   1.00
                  2.940000D+03          -1.230000D-04
                  4.412000D+02          -9.660000D-04
                  1.005000D+02          -4.831000D-03
                  2.843000D+01          -1.931400D-02
                  9.169000D+00          -5.328000D-02
                  3.196000D+00          -1.207230D-01
                  1.159000D+00          -1.334350D-01
                  1.811000D-01           5.307670D-01
                  5.890000D-02           5.801170D-01
            S    1   1.00
                  5.890000D-02           1.000000D+00
            S    1   1.00
                  1.790000D-02           1.000000D+00
            P    4   1.00
                  3.619000D+00           2.911100D-02
                  7.110000D-01           1.693650D-01
                  1.951000D-01           5.134580D-01
                  6.018000D-02           4.793380D-01
            P    1   1.00
                  6.018000D-02           1.000000D+00
            P    1   1.00
                  1.110000D-02           1.000000D+00
            D    1   1.00
                  2.354000D-01           1.0000000
            D    1   1.00
                  7.220000D-02           1.000000D+00
            ****
            -B     0
            S    9   1.00
                  4.570000D+03           6.960000D-04
                  6.859000D+02           5.353000D-03
                  1.565000D+02           2.713400D-02
                  4.447000D+01           1.013800D-01
                  1.448000D+01           2.720550D-01
                  5.131000D+00           4.484030D-01
                  1.898000D+00           2.901230D-01
                  3.329000D-01           1.432200D-02
                  1.043000D-01          -3.486000D-03
            S    9   1.00
                  4.570000D+03          -1.390000D-04
                  6.859000D+02          -1.097000D-03
                  1.565000D+02          -5.444000D-03
                  4.447000D+01          -2.191600D-02
                  1.448000D+01          -5.975100D-02
                  5.131000D+00          -1.387320D-01
                  1.898000D+00          -1.314820D-01
                  3.329000D-01           5.395260D-01
                  1.043000D-01           5.807740D-01
            S    1   1.00
                  1.043000D-01           1.000000D+00
            S    1   1.00
                  0.0310500              1.0000000
            P    4   1.00
                  6.001000D+00           3.548100D-02
                  1.241000D+00           1.980720D-01
                  3.364000D-01           5.052300D-01
                  9.538000D-02           4.794990D-01
            P    1   1.00
                  9.538000D-02           1.000000D+00
            P    1   1.00
                  0.0237800              1.0000000
            D    1   1.00
                  3.430000D-01           1.0000000
            D    1   1.00
                  0.0904000              1.0000000
            ****
            -C     0
            S    9   1.00
                  6.665000D+03           6.920000D-04
                  1.000000D+03           5.329000D-03
                  2.280000D+02           2.707700D-02
                  6.471000D+01           1.017180D-01
                  2.106000D+01           2.747400D-01
                  7.495000D+00           4.485640D-01
                  2.797000D+00           2.850740D-01
                  5.215000D-01           1.520400D-02
                  1.596000D-01          -3.191000D-03
            S    9   1.00
                  6.665000D+03          -1.460000D-04
                  1.000000D+03          -1.154000D-03
                  2.280000D+02          -5.725000D-03
                  6.471000D+01          -2.331200D-02
                  2.106000D+01          -6.395500D-02
                  7.495000D+00          -1.499810D-01
                  2.797000D+00          -1.272620D-01
                  5.215000D-01           5.445290D-01
                  1.596000D-01           5.804960D-01
            S    1   1.00
                  1.596000D-01           1.000000D+00
            S    1   1.00
                  0.0469000              1.0000000
            P    4   1.00
                  9.439000D+00           3.810900D-02
                  2.002000D+00           2.094800D-01
                  5.456000D-01           5.085570D-01
                  1.517000D-01           4.688420D-01
            P    1   1.00
                  1.517000D-01           1.000000D+00
            P    1   1.00
                  0.0404100              1.0000000
            D    1   1.00
                  5.500000D-01           1.0000000
            D    1   1.00
                  0.1510000              1.0000000
            ****
            -N     0
            S    9   1.00
                  9.046000D+03           7.000000D-04
                  1.357000D+03           5.389000D-03
                  3.093000D+02           2.740600D-02
                  8.773000D+01           1.032070D-01
                  2.856000D+01           2.787230D-01
                  1.021000D+01           4.485400D-01
                  3.838000D+00           2.782380D-01
                  7.466000D-01           1.544000D-02
                  2.248000D-01          -2.864000D-03
            S    9   1.00
                  9.046000D+03          -1.530000D-04
                  1.357000D+03          -1.208000D-03
                  3.093000D+02          -5.992000D-03
                  8.773000D+01          -2.454400D-02
                  2.856000D+01          -6.745900D-02
                  1.021000D+01          -1.580780D-01
                  3.838000D+00          -1.218310D-01
                  7.466000D-01           5.490030D-01
                  2.248000D-01           5.788150D-01
            S    1   1.00
                  2.248000D-01           1.000000D+00
            S    1   1.00
                  0.0612400              1.0000000
            P    4   1.00
                  1.355000D+01           3.991900D-02
                  2.917000D+00           2.171690D-01
                  7.973000D-01           5.103190D-01
                  2.185000D-01           4.622140D-01
            P    1   1.00
                  2.185000D-01           1.000000D+00
            P    1   1.00
                  0.0561100              1.0000000
            D    1   1.00
                  8.170000D-01           1.0000000
            D    1   1.00
                  0.2300000              1.0000000
            ****
            -O     0
            S    9   1.00
                  1.172000D+04           7.100000D-04
                  1.759000D+03           5.470000D-03
                  4.008000D+02           2.783700D-02
                  1.137000D+02           1.048000D-01
                  3.703000D+01           2.830620D-01
                  1.327000D+01           4.487190D-01
                  5.025000D+00           2.709520D-01
                  1.013000D+00           1.545800D-02
                  3.023000D-01          -2.585000D-03
            S    9   1.00
                  1.172000D+04          -1.600000D-04
                  1.759000D+03          -1.263000D-03
                  4.008000D+02          -6.267000D-03
                  1.137000D+02          -2.571600D-02
                  3.703000D+01          -7.092400D-02
                  1.327000D+01          -1.654110D-01
                  5.025000D+00          -1.169550D-01
                  1.013000D+00           5.573680D-01
                  3.023000D-01           5.727590D-01
            S    1   1.00
                  3.023000D-01           1.000000D+00
            S    1   1.00
                  0.0789600              1.0000000
            P    4   1.00
                  1.770000D+01           4.301800D-02
                  3.854000D+00           2.289130D-01
                  1.046000D+00           5.087280D-01
                  2.753000D-01           4.605310D-01
            P    1   1.00
                  2.753000D-01           1.000000D+00
            P    1   1.00
                  0.0685600              1.0000000
            D    1   1.00
                  1.185000D+00           1.0000000
            D    1   1.00
                  0.3320000              1.0000000
            ****
            -F     0
            S    9   1.00
                  1.471000D+04           7.210000D-04
                  2.207000D+03           5.553000D-03
                  5.028000D+02           2.826700D-02
                  1.426000D+02           1.064440D-01
                  4.647000D+01           2.868140D-01
                  1.670000D+01           4.486410D-01
                  6.356000D+00           2.647610D-01
                  1.316000D+00           1.533300D-02
                  3.897000D-01          -2.332000D-03
            S    9   1.00
                  1.471000D+04          -1.650000D-04
                  2.207000D+03          -1.308000D-03
                  5.028000D+02          -6.495000D-03
                  1.426000D+02          -2.669100D-02
                  4.647000D+01          -7.369000D-02
                  1.670000D+01          -1.707760D-01
                  6.356000D+00          -1.123270D-01
                  1.316000D+00           5.628140D-01
                  3.897000D-01           5.687780D-01
            S    1   1.00
                  3.897000D-01           1.000000D+00
            S    1   1.00
                  0.0986300              1.0000000
            P    4   1.00
                  2.267000D+01           4.487800D-02
                  4.977000D+00           2.357180D-01
                  1.347000D+00           5.085210D-01
                  3.471000D-01           4.581200D-01
            P    1   1.00
                  3.471000D-01           1.000000D+00
            P    1   1.00
                  0.0850200              1.0000000
            D    1   1.00
                  1.640000D+00           1.0000000
            D    1   1.00
                  0.4640000              1.0000000
            ****
            -Ne     0
            S    9   1.00
                  1.788000D+04           7.380000D-04
                  2.683000D+03           5.677000D-03
                  6.115000D+02           2.888300D-02
                  1.735000D+02           1.085400D-01
                  5.664000D+01           2.909070D-01
                  2.042000D+01           4.483240D-01
                  7.810000D+00           2.580260D-01
                  1.653000D+00           1.506300D-02
                  4.869000D-01          -2.100000D-03
            S    9   1.00
                  1.788000D+04          -1.720000D-04
                  2.683000D+03          -1.357000D-03
                  6.115000D+02          -6.737000D-03
                  1.735000D+02          -2.766300D-02
                  5.664000D+01          -7.620800D-02
                  2.042000D+01          -1.752270D-01
                  7.810000D+00          -1.070380D-01
                  1.653000D+00           5.670500D-01
                  4.869000D-01           5.652160D-01
            S    1   1.00
                  4.869000D-01           1.000000D+00
            S    1   1.00
                  0.1230000              1.0000000
            P    4   1.00
                  2.839000D+01           4.608700D-02
                  6.270000D+00           2.401810D-01
                  1.695000D+00           5.087440D-01
                  4.317000D-01           4.556600D-01
            P    1   1.00
                  4.317000D-01           1.000000D+00
            P    1   1.00
                  0.1064000              1.0000000
            D    1   1.00
                  2.202000D+00           1.0000000
            D    1   1.00
                  0.6310000              1.0000000
            ****
            -Na     0
            S    12   1.00
                  3.170000D+04           4.588780D-04
                  4.755000D+03           3.550700D-03
                  1.082000D+03           1.826180D-02
                  3.064000D+02           7.166500D-02
                  9.953000D+01           2.123460D-01
                  3.542000D+01           4.162030D-01
                  1.330000D+01           3.730200D-01
                  4.392000D+00           6.250540D-02
                  1.676000D+00          -6.245320D-03
                  5.889000D-01           2.433740D-03
                  5.640000D-02          -4.423810D-04
                  2.307000D-02           2.419240D-04
            S    12   1.00
                  3.170000D+04          -1.121620D-04
                  4.755000D+03          -8.685120D-04
                  1.082000D+03          -4.513300D-03
                  3.064000D+02          -1.814360D-02
                  9.953000D+01          -5.807990D-02
                  3.542000D+01          -1.376530D-01
                  1.330000D+01          -1.939080D-01
                  4.392000D+00           8.580090D-02
                  1.676000D+00           6.044190D-01
                  5.889000D-01           4.417190D-01
                  5.640000D-02           1.305470D-02
                  2.307000D-02          -5.680850D-03
            S    12   1.00
                  3.170000D+04           1.701600D-05
                  4.755000D+03           1.306930D-04
                  1.082000D+03           6.877840D-04
                  3.064000D+02           2.723590D-03
                  9.953000D+01           8.955290D-03
                  3.542000D+01           2.078320D-02
                  1.330000D+01           3.193800D-02
                  4.392000D+00          -1.913680D-02
                  1.676000D+00          -1.025950D-01
                  5.889000D-01          -1.989450D-01
                  5.640000D-02           6.559520D-01
                  2.307000D-02           4.311530D-01
            S    1   1.00
                  2.307000D-02           1.000000D+00
            S    1   1.00
                  7.200000D-03           1.000000D+00
            P    8   1.00
                  1.381000D+02           5.796410D-03
                  3.224000D+01           4.157560D-02
                  9.985000D+00           1.628730D-01
                  3.484000D+00           3.594010D-01
                  1.231000D+00           4.499880D-01
                  4.177000D-01           2.275070D-01
                  6.513000D-02           8.082470D-03
                  2.053000D-02          -1.962930D-03
            P    8   1.00
                  1.381000D+02          -5.815310D-04
                  3.224000D+01          -4.073060D-03
                  9.985000D+00          -1.679370D-02
                  3.484000D+00          -3.532680D-02
                  1.231000D+00          -5.219710D-02
                  4.177000D-01          -1.683590D-02
                  6.513000D-02           4.346130D-01
                  2.053000D-02           6.582180D-01
            P    1   1.00
                  2.053000D-02           1.000000D+00
            P    1   1.00
                  5.700000D-03           1.000000D+00
            D    1   1.00
                  9.280000D-02           1.0000000
            D    1   1.00
                  4.800000D-02           1.000000D+00
            ****
            -Mg     0
            S    12   1.00
                  4.739000D+04           3.460230D-04
                  7.108000D+03           2.680770D-03
                  1.618000D+03           1.383670D-02
                  4.584000D+02           5.517670D-02
                  1.493000D+02           1.696600D-01
                  5.359000D+01           3.647030D-01
                  2.070000D+01           4.068560D-01
                  8.384000D+00           1.350890D-01
                  2.542000D+00           4.908840D-03
                  8.787000D-01           2.864600D-04
                  1.077000D-01           2.645900D-05
                  3.999000D-02          -1.127080D-05
            S    12   1.00
                  4.739000D+04          -8.778390D-05
                  7.108000D+03          -6.747250D-04
                  1.618000D+03          -3.556030D-03
                  4.584000D+02          -1.421540D-02
                  1.493000D+02          -4.767480D-02
                  5.359000D+01          -1.148920D-01
                  2.070000D+01          -2.006760D-01
                  8.384000D+00          -3.412240D-02
                  2.542000D+00           5.704540D-01
                  8.787000D-01           5.423090D-01
                  1.077000D-01           2.181280D-02
                  3.999000D-02          -8.277000D-03
            S    12   1.00
                  4.739000D+04           1.696280D-05
                  7.108000D+03           1.298650D-04
                  1.618000D+03           6.888310D-04
                  4.584000D+02           2.735330D-03
                  1.493000D+02           9.312240D-03
                  5.359000D+01           2.232650D-02
                  2.070000D+01           4.111950D-02
                  8.384000D+00           5.456420D-03
                  2.542000D+00          -1.340120D-01
                  8.787000D-01          -2.561760D-01
                  1.077000D-01           6.058560D-01
                  3.999000D-02           5.094460D-01
            S    1   1.00
                  3.999000D-02           1.000000D+00
            S    1   1.00
                  1.420000D-02           1.000000D+00
            P    8   1.00
                  1.799000D+02           5.381610D-03
                  4.214000D+01           3.924180D-02
                  1.313000D+01           1.574450D-01
                  4.628000D+00           3.585350D-01
                  1.670000D+00           4.572260D-01
                  5.857000D-01           2.159180D-01
                  1.311000D-01           6.649480D-03
                  4.112000D-02          -1.253040D-04
            P    8   1.00
                  1.799000D+02          -8.659480D-04
                  4.214000D+01          -6.159780D-03
                  1.313000D+01          -2.615190D-02
                  4.628000D+00          -5.706470D-02
                  1.670000D+00          -8.739060D-02
                  5.857000D-01          -1.229900D-02
                  1.311000D-01           5.020850D-01
                  4.112000D-02           5.972450D-01
            P    1   1.00
                  4.112000D-02           1.000000D+00
            P    1   1.00
                  1.050000D-02           1.000000D+00
            D    1   1.00
                  1.932000D-01           1.0000000
            D    1   1.00
                  6.050000D-02           1.000000D+00
            ****
            -Al     0
            S    12   1.00
                  6.415000D+04           2.902500D-04
                  9.617000D+03           2.250640D-03
                  2.189000D+03           1.164590D-02
                  6.205000D+02           4.673770D-02
                  2.027000D+02           1.462990D-01
                  7.315000D+01           3.302830D-01
                  2.855000D+01           4.158610D-01
                  1.177000D+01           1.892530D-01
                  3.300000D+00           1.158890D-02
                  1.173000D+00          -1.283850D-03
                  1.752000D-01           4.258830D-04
                  6.473000D-02          -1.992800D-04
            S    12   1.00
                  6.415000D+04          -7.580480D-05
                  9.617000D+03          -5.817910D-04
                  2.189000D+03          -3.081130D-03
                  6.205000D+02          -1.231120D-02
                  2.027000D+02          -4.197810D-02
                  7.315000D+01          -1.033710D-01
                  2.855000D+01          -1.963080D-01
                  1.177000D+01          -8.300020D-02
                  3.300000D+00           5.410400D-01
                  1.173000D+00           5.787960D-01
                  1.752000D-01           2.881470D-02
                  6.473000D-02          -9.537950D-03
            S    12   1.00
                  6.415000D+04           1.750780D-05
                  9.617000D+03           1.342080D-04
                  2.189000D+03           7.124420D-04
                  6.205000D+02           2.843300D-03
                  2.027000D+02           9.768420D-03
                  7.315000D+01           2.418500D-02
                  2.855000D+01           4.749930D-02
                  1.177000D+01           2.036210D-02
                  3.300000D+00          -1.587880D-01
                  1.173000D+00          -3.116940D-01
                  1.752000D-01           6.201470D-01
                  6.473000D-02           5.209430D-01
            S    1   1.00
                  6.473000D-02           1.000000D+00
            S    1   1.00
                  0.0231000              1.0000000
            P    8   1.00
                  2.588000D+02           4.068470D-03
                  6.089000D+01           3.068150D-02
                  1.914000D+01           1.291490D-01
                  6.881000D+00           3.208310D-01
                  2.574000D+00           4.538150D-01
                  9.572000D-01           2.750660D-01
                  2.099000D-01           1.908070D-02
                  5.986000D-02          -3.128480D-03
            P    8   1.00
                  2.588000D+02          -7.480530D-04
                  6.089000D+01          -5.457960D-03
                  1.914000D+01          -2.453710D-02
                  6.881000D+00          -5.821380D-02
                  2.574000D+00          -9.837560D-02
                  9.572000D-01          -2.600640D-02
                  2.099000D-01           4.640200D-01
                  5.986000D-02           6.488700D-01
            P    1   1.00
                  5.986000D-02           1.000000D+00
            P    1   1.00
                  0.0153000              1.0000000
            D    1   1.00
                  1.890000D-01           1.0000000
            D    1   1.00
                  0.0535000              1.0000000
            ****
            -Si     0
            S    12   1.00
                  7.886000D+04           2.704430D-04
                  1.182000D+04           2.097170D-03
                  2.692000D+03           1.085060D-02
                  7.634000D+02           4.367540D-02
                  2.496000D+02           1.376530D-01
                  9.028000D+01           3.166440D-01
                  3.529000D+01           4.185810D-01
                  1.451000D+01           2.102120D-01
                  4.053000D+00           1.449520D-02
                  1.482000D+00          -2.035900D-03
                  2.517000D-01           6.241860D-04
                  9.243000D-02          -2.828720D-04
            S    12   1.00
                  7.886000D+04          -7.231770D-05
                  1.182000D+04          -5.551160D-04
                  2.692000D+03          -2.938050D-03
                  7.634000D+02          -1.176870D-02
                  2.496000D+02          -4.029070D-02
                  9.028000D+01          -1.006090D-01
                  3.529000D+01          -1.965280D-01
                  1.451000D+01          -1.023820D-01
                  4.053000D+00           5.271900D-01
                  1.482000D+00           5.932510D-01
                  2.517000D-01           3.326520D-02
                  9.243000D-02          -9.736620D-03
            S    12   1.00
                  7.886000D+04           1.851130D-05
                  1.182000D+04           1.422360D-04
                  2.692000D+03           7.521850D-04
                  7.634000D+02           3.022790D-03
                  2.496000D+02           1.036770D-02
                  9.028000D+01           2.625630D-02
                  3.529000D+01           5.239890D-02
                  1.451000D+01           2.909590D-02
                  4.053000D+00          -1.780030D-01
                  1.482000D+00          -3.468740D-01
                  2.517000D-01           6.230200D-01
                  9.243000D-02           5.377120D-01
            S    1   1.00
                  9.243000D-02           1.000000D+00
            S    1   1.00
                  0.0332000              1.0000000
            P    8   1.00
                  3.159000D+02           3.926560D-03
                  7.442000D+01           2.988110D-02
                  2.348000D+01           1.272120D-01
                  8.488000D+00           3.209430D-01
                  3.217000D+00           4.554290D-01
                  1.229000D+00           2.685630D-01
                  2.964000D-01           1.883360D-02
                  8.768000D-02          -2.624310D-03
            P    8   1.00
                  3.159000D+02          -8.583020D-04
                  7.442000D+01          -6.303280D-03
                  2.348000D+01          -2.882550D-02
                  8.488000D+00          -6.945600D-02
                  3.217000D+00          -1.194930D-01
                  1.229000D+00          -1.995810D-02
                  2.964000D-01           5.102680D-01
                  8.768000D-02           6.003820D-01
            P    1   1.00
                  8.768000D-02           1.000000D+00
            P    1   1.00
                  0.0250000              1.0000000
            D    1   1.00
                  2.750000D-01           1.0000000
            D    1   1.00
                  0.0823000              1.0000000
            ****
            -P     0
            S    12   1.00
                  9.484000D+04           2.555090D-04
                  1.422000D+04           1.981930D-03
                  3.236000D+03           1.027600D-02
                  9.171000D+02           4.148230D-02
                  2.995000D+02           1.319840D-01
                  1.081000D+02           3.086620D-01
                  4.218000D+01           4.206470D-01
                  1.728000D+01           2.228780D-01
                  4.858000D+00           1.640350D-02
                  1.818000D+00          -2.542550D-03
                  3.372000D-01           7.480500D-04
                  1.232000D-01          -3.309630D-04
            S    12   1.00
                  9.484000D+04          -6.969390D-05
                  1.422000D+04          -5.352660D-04
                  3.236000D+03          -2.837090D-03
                  9.171000D+02          -1.139830D-02
                  2.995000D+02          -3.929290D-02
                  1.081000D+02          -9.963640D-02
                  4.218000D+01          -1.979830D-01
                  1.728000D+01          -1.148600D-01
                  4.858000D+00           5.185950D-01
                  1.818000D+00           6.018470D-01
                  3.372000D-01           3.686120D-02
                  1.232000D-01          -9.707590D-03
            S    12   1.00
                  9.484000D+04           1.911990D-05
                  1.422000D+04           1.472230D-04
                  3.236000D+03           7.779120D-04
                  9.171000D+02           3.145460D-03
                  2.995000D+02           1.082000D-02
                  1.081000D+02           2.799570D-02
                  4.218000D+01           5.639780D-02
                  1.728000D+01           3.581900D-02
                  4.858000D+00          -1.933870D-01
                  1.818000D+00          -3.720970D-01
                  3.372000D-01           6.242460D-01
                  1.232000D-01           5.517210D-01
            S    1   1.00
                  1.232000D-01           1.000000D+00
            S    1   1.00
                  0.0417000              1.0000000
            P    8   1.00
                  3.705000D+02           3.950050D-03
                  8.733000D+01           3.024920D-02
                  2.759000D+01           1.295540D-01
                  1.000000D+01           3.275940D-01
                  3.825000D+00           4.569920D-01
                  1.494000D+00           2.530860D-01
                  3.921000D-01           1.687980D-02
                  1.186000D-01          -2.070930D-03
            P    8   1.00
                  3.705000D+02          -9.598320D-04
                  8.733000D+01          -7.111770D-03
                  2.759000D+01          -3.271220D-02
                  1.000000D+01          -7.957840D-02
                  3.825000D+00          -1.350160D-01
                  1.494000D+00          -9.105850D-03
                  3.921000D-01           5.378020D-01
                  1.186000D-01           5.690660D-01
            P    1   1.00
                  1.186000D-01           1.000000D+00
            P    1   1.00
                  0.0343000              1.0000000
            D    1   1.00
                  3.730000D-01           1.0000000
            D    1   1.00
                  0.1130000              1.0000000
            ****
            -S     0
            S    12   1.00
                  1.108000D+05           2.476350D-04
                  1.661000D+04           1.920260D-03
                  3.781000D+03           9.961920D-03
                  1.071000D+03           4.029750D-02
                  3.498000D+02           1.286040D-01
                  1.263000D+02           3.034800D-01
                  4.926000D+01           4.214320D-01
                  2.016000D+01           2.307810D-01
                  5.720000D+00           1.789710D-02
                  2.182000D+00          -2.975160D-03
                  4.327000D-01           8.495220D-04
                  1.570000D-01          -3.679360D-04
            S    12   1.00
                  1.108000D+05          -6.870390D-05
                  1.661000D+04          -5.276810D-04
                  3.781000D+03          -2.796710D-03
                  1.071000D+03          -1.126510D-02
                  3.498000D+02          -3.888340D-02
                  1.263000D+02          -9.950250D-02
                  4.926000D+01          -1.997400D-01
                  2.016000D+01          -1.233600D-01
                  5.720000D+00           5.131940D-01
                  2.182000D+00           6.071200D-01
                  4.327000D-01           3.967530D-02
                  1.570000D-01          -9.468640D-03
            S    12   1.00
                  1.108000D+05           1.990770D-05
                  1.661000D+04           1.534830D-04
                  3.781000D+03           8.095030D-04
                  1.071000D+03           3.289740D-03
                  3.498000D+02           1.129670D-02
                  1.263000D+02           2.963850D-02
                  4.926000D+01           5.998510D-02
                  2.016000D+01           4.132480D-02
                  5.720000D+00          -2.074740D-01
                  2.182000D+00          -3.928890D-01
                  4.327000D-01           6.328400D-01
                  1.570000D-01           5.569240D-01
            S    1   1.00
                  1.570000D-01           1.000000D+00
            S    1   1.00
                  0.0507000              1.0000000
            P    8   1.00
                  3.997000D+02           4.475410D-03
                  9.419000D+01           3.417080D-02
                  2.975000D+01           1.442500D-01
                  1.077000D+01           3.539280D-01
                  4.119000D+00           4.590850D-01
                  1.625000D+00           2.063830D-01
                  4.726000D-01           1.021410D-02
                  1.407000D-01          -6.031220D-05
            P    8   1.00
                  3.997000D+02          -1.162510D-03
                  9.419000D+01          -8.656640D-03
                  2.975000D+01          -3.908860D-02
                  1.077000D+01          -9.346250D-02
                  4.119000D+00          -1.479940D-01
                  1.625000D+00           3.019040D-02
                  4.726000D-01           5.615730D-01
                  1.407000D-01           5.347760D-01
            P    1   1.00
                  1.407000D-01           1.000000D+00
            P    1   1.00
                  0.0399000              1.0000000
            D    1   1.00
                  4.790000D-01           1.0000000
            D    1   1.00
                  0.1520000              1.0000000
            ****
            -Cl     0
            S    12   1.00
                  1.279000D+05           2.411530D-04
                  1.917000D+04           1.870950D-03
                  4.363000D+03           9.708270D-03
                  1.236000D+03           3.931530D-02
                  4.036000D+02           1.259320D-01
                  1.457000D+02           2.993410D-01
                  5.681000D+01           4.218860D-01
                  2.323000D+01           2.372010D-01
                  6.644000D+00           1.915310D-02
                  2.575000D+00          -3.347920D-03
                  5.371000D-01           9.298830D-04
                  1.938000D-01          -3.963790D-04
            S    12   1.00
                  1.279000D+05          -6.789220D-05
                  1.917000D+04          -5.218360D-04
                  4.363000D+03          -2.765130D-03
                  1.236000D+03          -1.115370D-02
                  4.036000D+02          -3.859190D-02
                  1.457000D+02          -9.948480D-02
                  5.681000D+01          -2.013920D-01
                  2.323000D+01          -1.303130D-01
                  6.644000D+00           5.094430D-01
                  2.575000D+00           6.107250D-01
                  5.371000D-01           4.215490D-02
                  1.938000D-01          -9.234270D-03
            S    12   1.00
                  1.279000D+05           2.049860D-05
                  1.917000D+04           1.582980D-04
                  4.363000D+03           8.336390D-04
                  1.236000D+03           3.398800D-03
                  4.036000D+02           1.167380D-02
                  1.457000D+02           3.096220D-02
                  5.681000D+01           6.295330D-02
                  2.323000D+01           4.602570D-02
                  6.644000D+00          -2.193120D-01
                  2.575000D+00          -4.087730D-01
                  5.371000D-01           6.384650D-01
                  1.938000D-01           5.623620D-01
            S    1   1.00
                  1.938000D-01           1.000000D+00
            S    1   1.00
                  0.0608000              1.0000000
            P    8   1.00
                  4.176000D+02           5.259820D-03
                  9.833000D+01           3.983320D-02
                  3.104000D+01           1.646550D-01
                  1.119000D+01           3.873220D-01
                  4.249000D+00           4.570720D-01
                  1.624000D+00           1.516360D-01
                  5.322000D-01           1.816150D-03
                  1.620000D-01           1.882960D-03
            P    8   1.00
                  4.176000D+02          -1.435700D-03
                  9.833000D+01          -1.077960D-02
                  3.104000D+01          -4.700750D-02
                  1.119000D+01          -1.110300D-01
                  4.249000D+00          -1.532750D-01
                  1.624000D+00           8.946090D-02
                  5.322000D-01           5.794440D-01
                  1.620000D-01           4.832720D-01
            P    1   1.00
                  1.620000D-01           1.000000D+00
            P    1   1.00
                  0.0466000              1.0000000
            D    1   1.00
                  6.000000D-01           1.0000000
            D    1   1.00
                  0.1960000              1.0000000
            ****
            -Ar     0
            S    12   1.00
                  1.457000D+05           2.367000D-04
                  2.184000D+04           1.835230D-03
                  4.972000D+03           9.528600D-03
                  1.408000D+03           3.862830D-02
                  4.597000D+02           1.240810D-01
                  1.659000D+02           2.964710D-01
                  6.469000D+01           4.220680D-01
                  2.644000D+01           2.417110D-01
                  7.628000D+00           2.005090D-02
                  2.996000D+00          -3.610000D-03
                  6.504000D-01           9.756070D-04
                  2.337000D-01          -4.113160D-04
            S    12   1.00
                  1.457000D+05          -6.749100D-05
                  2.184000D+04          -5.185220D-04
                  4.972000D+03          -2.748250D-03
                  1.408000D+03          -1.110070D-02
                  4.597000D+02          -3.848200D-02
                  1.659000D+02          -9.975990D-02
                  6.469000D+01          -2.030880D-01
                  2.644000D+01          -1.356080D-01
                  7.628000D+00           5.071950D-01
                  2.996000D+00           6.128980D-01
                  6.504000D-01           4.429680D-02
                  2.337000D-01          -8.992780D-03
            S    12   1.00
                  1.457000D+05           2.104570D-05
                  2.184000D+04           1.625650D-04
                  4.972000D+03           8.554630D-04
                  1.408000D+03           3.497450D-03
                  4.597000D+02           1.201560D-02
                  1.659000D+02           3.213680D-02
                  6.469000D+01           6.552790D-02
                  2.644000D+01           4.993700D-02
                  7.628000D+00          -2.297690D-01
                  2.996000D+00          -4.210060D-01
                  6.504000D-01           6.423310D-01
                  2.337000D-01           5.675400D-01
            S    1   1.00
                  2.337000D-01           1.000000D+00
            S    1   1.00
                  0.0709000              1.0000000
            P    8   1.00
                  4.537000D+02           5.705550D-03
                  1.068000D+02           4.304600D-02
                  3.373000D+01           1.765910D-01
                  1.213000D+01           4.068630D-01
                  4.594000D+00           4.525490D-01
                  1.678000D+00           1.228010D-01
                  5.909000D-01          -4.459960D-03
                  1.852000D-01           2.052250D-03
            P    8   1.00
                  4.537000D+02          -1.606550D-03
                  1.068000D+02          -1.217140D-02
                  3.373000D+01          -5.207890D-02
                  1.213000D+01          -1.237370D-01
                  4.594000D+00          -1.516190D-01
                  1.678000D+00           1.424250D-01
                  5.909000D-01           5.845010D-01
                  1.852000D-01           4.375400D-01
            P    1   1.00
                  1.852000D-01           1.000000D+00
            P    1   1.00
                  0.0533000              1.0000000
            D    1   1.00
                  7.380000D-01           1.0000000
            D    1   1.00
                  0.2400000              1.0000000
            ****
            -Sc     0
            S    20   1.00
                  2.715278D+06           8.147221D-06
                  4.065984D+05           6.334788D-05
                  9.253004D+04           3.330384D-04
                  2.620792D+04           1.404055D-03
                  8.549429D+03           5.081725D-03
                  3.085975D+03           1.626926D-02
                  1.203172D+03           4.624577D-02
                  4.984869D+02           1.137223D-01
                  2.167360D+02           2.257636D-01
                  9.787476D+01           3.106700D-01
                  4.520433D+01           2.191906D-01
                  2.021187D+01           7.215879D-02
                  9.574751D+00           1.187030D-01
                  4.540346D+00           1.220532D-01
                  1.995687D+00           2.136795D-02
                  9.422150D-01          -5.357246D-04
                  4.178450D-01           2.435774D-04
                  9.576100D-02          -8.796617D-05
                  5.135100D-02           7.878246D-05
                  2.387800D-02          -1.637155D-05
            S    20   1.00
                  2.715278D+06          -4.722109D-06
                  4.065984D+05          -3.671829D-05
                  9.253004D+04          -1.930883D-04
                  2.620792D+04          -8.146870D-04
                  8.549429D+03          -2.955526D-03
                  3.085975D+03          -9.520035D-03
                  1.203172D+03          -2.746858D-02
                  4.984869D+02          -6.991528D-02
                  2.167360D+02          -1.499251D-01
                  9.787476D+01          -2.459153D-01
                  4.520433D+01          -2.401293D-01
                  2.021187D+01           3.567987D-02
                  9.574751D+00           4.915023D-01
                  4.540346D+00           4.911381D-01
                  1.995687D+00           9.120633D-02
                  9.422150D-01          -5.356723D-03
                  4.178450D-01           8.812836D-04
                  9.576100D-02          -7.605536D-04
                  5.135100D-02           6.340116D-04
                  2.387800D-02          -1.556163D-04
            S    20   1.00
                  2.715278D+06           9.139905D-07
                  4.065984D+05           7.108513D-06
                  9.253004D+04           3.738126D-05
                  2.620792D+04           1.578828D-04
                  8.549429D+03           5.737686D-04
                  3.085975D+03           1.859244D-03
                  1.203172D+03           5.433182D-03
                  4.984869D+02           1.425387D-02
                  2.167360D+02           3.246144D-02
                  9.787476D+01           6.003454D-02
                  4.520433D+01           6.916105D-02
                  2.021187D+01          -2.113084D-02
                  9.574751D+00          -2.666832D-01
                  4.540346D+00          -4.367591D-01
                  1.995687D+00           6.498243D-02
                  9.422150D-01           7.009599D-01
                  4.178450D-01           4.515562D-01
                  9.576100D-02           3.011910D-02
                  5.135100D-02          -1.329480D-02
                  2.387800D-02           4.633679D-03
            S    20   1.00
                  2.715278D+06          -2.201951D-07
                  4.065984D+05          -1.711419D-06
                  9.253004D+04          -9.008469D-06
                  2.620792D+04          -3.799997D-05
                  8.549429D+03          -1.383227D-04
                  3.085975D+03          -4.473692D-04
                  1.203172D+03          -1.310691D-03
                  4.984869D+02          -3.429860D-03
                  2.167360D+02          -7.847579D-03
                  9.787476D+01          -1.447189D-02
                  4.520433D+01          -1.690669D-02
                  2.021187D+01           5.396115D-03
                  9.574751D+00           6.671062D-02
                  4.540346D+00           1.178356D-01
                  1.995687D+00          -2.738134D-02
                  9.422150D-01          -2.260149D-01
                  4.178450D-01          -3.073539D-01
                  9.576100D-02           2.544054D-01
                  5.135100D-02           5.981590D-01
                  2.387800D-02           3.115202D-01
            S    20   1.00
                  2.715278D+06          -3.757238D-07
                  4.065984D+05          -2.981907D-06
                  9.253004D+04          -1.522586D-05
                  2.620792D+04          -6.684686D-05
                  8.549429D+03          -2.313129D-04
                  3.085975D+03          -7.959729D-04
                  1.203172D+03          -2.161961D-03
                  4.984869D+02          -6.206459D-03
                  2.167360D+02          -1.261905D-02
                  9.787476D+01          -2.739459D-02
                  4.520433D+01          -2.336516D-02
                  2.021187D+01          -5.734627D-03
                  9.574751D+00           1.536025D-01
                  4.540346D+00           1.447100D-01
                  1.995687D+00           9.359699D-02
                  9.422150D-01          -8.687730D-01
                  4.178450D-01           2.114597D-02
                  9.576100D-02           2.275498D+00
                  5.135100D-02          -1.190770D+00
                  2.387800D-02          -7.674257D-01
            S    1   1.00
                  2.387800D-02           1.000000D+00
            S    1   1.00
                  1.110000D-02           1.000000D+00
            P    16   1.00
                  1.059219D+04           4.500000D-05
                  2.507533D+03           4.010000D-04
                  8.144571D+02           2.302000D-03
                  3.115195D+02           1.003700D-02
                  1.319617D+02           3.495400D-02
                  5.998718D+01           9.790900D-02
                  2.866250D+01           2.106800D-01
                  1.410851D+01           3.300930D-01
                  7.103706D+00           3.310270D-01
                  3.609200D+00           1.579600D-01
                  1.776070D+00           2.209900D-02
                  8.547600D-01          -1.605000D-03
                  4.022390D-01          -1.326000D-03
                  1.546650D-01          -2.800000D-04
                  6.494500D-02           3.400000D-05
                  2.635900D-02          -1.300000D-05
            P    16   1.00
                  1.059219D+04          -1.500000D-05
                  2.507533D+03          -1.310000D-04
                  8.144571D+02          -7.570000D-04
                  3.115195D+02          -3.318000D-03
                  1.319617D+02          -1.170600D-02
                  5.998718D+01          -3.360400D-02
                  2.866250D+01          -7.487900D-02
                  1.410851D+01          -1.225480D-01
                  7.103706D+00          -1.302760D-01
                  3.609200D+00           1.459600D-02
                  1.776070D+00           3.091840D-01
                  8.547600D-01           4.629980D-01
                  4.022390D-01           3.049570D-01
                  1.546650D-01           5.087800D-02
                  6.494500D-02          -4.493000D-03
                  2.635900D-02           1.832000D-03
            P    16   1.00
                  1.059219D+04          -4.000000D-06
                  2.507533D+03          -3.200000D-05
                  8.144571D+02          -1.850000D-04
                  3.115195D+02          -8.080000D-04
                  1.319617D+02          -2.870000D-03
                  5.998718D+01          -8.207000D-03
                  2.866250D+01          -1.847300D-02
                  1.410851D+01          -3.010100D-02
                  7.103706D+00          -3.294300D-02
                  3.609200D+00           7.958000D-03
                  1.776070D+00           8.799300D-02
                  8.547600D-01           1.523770D-01
                  4.022390D-01           9.717000D-02
                  1.546650D-01          -2.569380D-01
                  6.494500D-02          -5.878150D-01
                  2.635900D-02          -3.054210D-01
            P    16   1.00
                  1.059219D+04           4.000000D-06
                  2.507533D+03           3.900000D-05
                  8.144571D+02           2.210000D-04
                  3.115195D+02           9.840000D-04
                  1.319617D+02           3.423000D-03
                  5.998718D+01           9.993000D-03
                  2.866250D+01           2.191600D-02
                  1.410851D+01           3.700800D-02
                  7.103706D+00           3.779400D-02
                  3.609200D+00          -4.379000D-03
                  1.776070D+00          -1.101640D-01
                  8.547600D-01          -1.610170D-01
                  4.022390D-01          -1.824820D-01
                  1.546650D-01           3.886110D-01
                  6.494500D-02           6.911000D-01
                  2.635900D-02           7.960400D-02
            P    1   1.00
                  2.635900D-02           1.000000D+00
            P    1   1.00
                  1.066000D-02           1.000000D+00
            D    8   1.00
                  5.051380D+01           4.266000D-03
                  1.474050D+01           2.770800D-02
                  5.195000D+00           1.000010D-01
                  2.028460D+00           2.315810D-01
                  8.040860D-01           3.460330D-01
                  3.076890D-01           3.733740D-01
                  1.113920D-01           2.642880D-01
                  3.735200D-02           6.366700D-02
            D    8   1.00
                  5.051380D+01          -4.389000D-03
                  1.474050D+01          -2.836300D-02
                  5.195000D+00          -1.051370D-01
                  2.028460D+00          -2.348540D-01
                  8.040860D-01          -3.246090D-01
                  3.076890D-01          -6.428900D-02
                  1.113920D-01           6.017490D-01
                  3.735200D-02           3.903000D-01
            D    1   1.00
                  3.735200D-02           1.000000D+00
            D    1   1.00
                  1.244000D-02           1.000000D+00
            F    2   1.00
                  7.126000D-01           3.617450D-01
                  1.636000D-01           8.218680D-01
            F    1   1.00
                  4.063000D-02           1.000000D+00
            ****
            -Ti     0
            S    20   1.00
                  3.014643D+06           8.060782D-06
                  4.514329D+05           6.267518D-05
                  1.027338D+05           3.295006D-04
                  2.909817D+04           1.389203D-03
                  9.492330D+03           5.028469D-03
                  3.426346D+03           1.610419D-02
                  1.335896D+03           4.581232D-02
                  5.535026D+02           1.128613D-01
                  2.406925D+02           2.248193D-01
                  1.087293D+02           3.114571D-01
                  5.026457D+01           2.224995D-01
                  2.258004D+01           7.293128D-02
                  1.071432D+01           1.160683D-01
                  5.093546D+00           1.194774D-01
                  2.244183D+00           2.097868D-02
                  1.059570D+00          -5.091715D-04
                  4.688490D-01           2.217859D-04
                  1.061430D-01          -7.636896D-05
                  5.526200D-02           7.719539D-05
                  2.546500D-02          -1.149056D-05
            S    20   1.00
                  3.014643D+06          -4.630486D-06
                  4.514329D+05          -3.600451D-05
                  1.027338D+05          -1.893420D-04
                  2.909817D+04          -7.988781D-04
                  9.492330D+03          -2.898698D-03
                  3.426346D+03          -9.339701D-03
                  1.335896D+03          -2.697464D-02
                  5.535026D+02          -6.878913D-02
                  2.406925D+02          -1.481037D-01
                  1.087293D+02          -2.445253D-01
                  5.026457D+01          -2.419916D-01
                  2.258004D+01           3.183790D-02
                  1.071432D+01           4.932686D-01
                  5.093546D+00           4.939655D-01
                  2.244183D+00           9.196313D-02
                  1.059570D+00          -5.316992D-03
                  4.688490D-01           8.085624D-04
                  1.061430D-01          -6.918459D-04
                  5.526200D-02           6.086512D-04
                  2.546500D-02          -1.313842D-04
            S    20   1.00
                  3.014643D+06           9.230559D-07
                  4.514329D+05           7.178974D-06
                  1.027338D+05           3.775134D-05
                  2.909817D+04           1.594532D-04
                  9.492330D+03           5.795150D-04
                  3.426346D+03           1.878414D-03
                  1.335896D+03           5.492747D-03
                  5.535026D+02           1.443297D-02
                  2.406925D+02           3.296408D-02
                  1.087293D+02           6.125493D-02
                  5.026457D+01           7.134113D-02
                  2.258004D+01          -1.973150D-02
                  1.071432D+01          -2.741869D-01
                  5.093546D+00          -4.440977D-01
                  2.244183D+00           7.776084D-02
                  1.059570D+00           7.068444D-01
                  4.688490D-01           4.413892D-01
                  1.061430D-01           2.799769D-02
                  5.526200D-02          -1.210790D-02
                  2.546500D-02           4.324762D-03
            S    20   1.00
                  3.014643D+06          -2.180323D-07
                  4.514329D+05          -1.694860D-06
                  1.027338D+05          -8.919208D-06
                  2.909817D+04          -3.763633D-05
                  9.492330D+03          -1.369575D-04
                  3.426346D+03          -4.432894D-04
                  1.335896D+03          -1.298868D-03
                  5.535026D+02          -3.406752D-03
                  2.406925D+02          -7.810829D-03
                  1.087293D+02          -1.449245D-02
                  5.026457D+01          -1.708136D-02
                  2.258004D+01           4.897666D-03
                  1.071432D+01           6.753108D-02
                  5.093546D+00           1.173318D-01
                  2.244183D+00          -2.985025D-02
                  1.059570D+00          -2.277634D-01
                  4.688490D-01          -2.928115D-01
                  1.061430D-01           2.665300D-01
                  5.526200D-02           5.912406D-01
                  2.546500D-02           3.037229D-01
            S    20   1.00
                  3.014643D+06          -3.975126D-07
                  4.514329D+05          -3.161080D-06
                  1.027338D+05          -1.609375D-05
                  2.909817D+04          -7.092947D-05
                  9.492330D+03          -2.442710D-04
                  3.426346D+03          -8.457892D-04
                  1.335896D+03          -2.282208D-03
                  5.535026D+02          -6.619873D-03
                  2.406925D+02          -1.335024D-02
                  1.087293D+02          -2.955830D-02
                  5.026457D+01          -2.477039D-02
                  2.258004D+01          -8.414624D-03
                  1.071432D+01           1.693855D-01
                  5.093546D+00           1.500787D-01
                  2.244183D+00           9.787777D-02
                  1.059570D+00          -9.653608D-01
                  4.688490D-01           1.489721D-01
                  1.061430D-01           2.191179D+00
                  5.526200D-02          -1.243325D+00
                  2.546500D-02          -6.711916D-01
            S    1   1.00
                  2.546500D-02           1.000000D+00
            S    1   1.00
                  1.173000D-02           1.000000D+00
            P    16   1.00
                  1.191203D+04           4.400000D-05
                  2.819947D+03           3.910000D-04
                  9.159479D+02           2.248000D-03
                  3.503842D+02           9.823000D-03
                  1.484825D+02           3.433800D-02
                  6.753944D+01           9.666600D-02
                  3.230332D+01           2.094170D-01
                  1.592786D+01           3.301890D-01
                  8.038035D+00           3.319360D-01
                  4.093916D+00           1.584880D-01
                  2.022390D+00           2.231000D-02
                  9.761020D-01          -1.566000D-03
                  4.595950D-01          -1.324000D-03
                  1.771520D-01          -2.710000D-04
                  7.351700D-02           3.200000D-05
                  2.940100D-02          -1.200000D-05
            P    16   1.00
                  1.191203D+04          -1.500000D-05
                  2.819947D+03          -1.310000D-04
                  9.159479D+02          -7.550000D-04
                  3.503842D+02          -3.319000D-03
                  1.484825D+02          -1.175000D-02
                  6.753944D+01          -3.392200D-02
                  3.230332D+01          -7.616400D-02
                  1.592786D+01          -1.257020D-01
                  8.038035D+00          -1.330980D-01
                  4.093916D+00           1.740600D-02
                  2.022390D+00           3.151650D-01
                  9.761020D-01           4.618140D-01
                  4.595950D-01           2.998560D-01
                  1.771520D-01           5.000000D-02
                  7.351700D-02          -4.230000D-03
                  2.940100D-02           1.725000D-03
            P    16   1.00
                  1.191203D+04           4.000000D-06
                  2.819947D+03           3.100000D-05
                  9.159479D+02           1.820000D-04
                  3.503842D+02           7.950000D-04
                  1.484825D+02           2.833000D-03
                  6.753944D+01           8.154000D-03
                  3.230332D+01           1.847200D-02
                  1.592786D+01           3.040000D-02
                  8.038035D+00           3.304700D-02
                  4.093916D+00          -8.251000D-03
                  2.022390D+00          -8.855400D-02
                  9.761020D-01          -1.496120D-01
                  4.595950D-01          -9.422700D-02
                  1.771520D-01           2.508460D-01
                  7.351700D-02           5.866430D-01
                  2.940100D-02           3.135350D-01
            P    16   1.00
                  1.191203D+04           4.000000D-06
                  2.819947D+03           3.900000D-05
                  9.159479D+02           2.230000D-04
                  3.503842D+02           9.920000D-04
                  1.484825D+02           3.476000D-03
                  6.753944D+01           1.017200D-02
                  3.230332D+01           2.257600D-02
                  1.592786D+01           3.823800D-02
                  8.038035D+00           3.933700D-02
                  4.093916D+00          -6.106000D-03
                  2.022390D+00          -1.129620D-01
                  9.761020D-01          -1.681140D-01
                  4.595950D-01          -1.659320D-01
                  1.771520D-01           3.914030D-01
                  7.351700D-02           6.818400D-01
                  2.940100D-02           8.403100D-02
            P    1   1.00
                  2.940100D-02           1.000000D+00
            P    1   1.00
                  1.176000D-02           1.000000D+00
            D    8   1.00
                  6.401300D+01           3.887000D-03
                  1.881790D+01           2.639900D-02
                  6.728700D+00           9.751100D-02
                  2.664130D+00           2.328480D-01
                  1.078680D+00           3.531520D-01
                  4.232090D-01           3.721860D-01
                  1.559990D-01           2.476720D-01
                  5.188400D-02           5.823600D-02
            D    8   1.00
                  6.401300D+01          -3.970000D-03
                  1.881790D+01          -2.687300D-02
                  6.728700D+00          -1.022750D-01
                  2.664130D+00          -2.377280D-01
                  1.078680D+00          -3.121140D-01
                  4.232090D-01          -4.237800D-02
                  1.559990D-01           5.886580D-01
                  5.188400D-02           4.103020D-01
            D    1   1.00
                  5.188400D-02           1.000000D+00
            D    1   1.00
                  1.726000D-02           1.000000D+00
            F    2   1.00
                  1.227400D+00           3.581580D-01
                  2.788000D-01           8.257940D-01
            F    1   1.00
                  8.266000D-02           1.000000D+00
            ****
            -V     0
            S    20   1.00
                  3.321857D+06           8.039999D-06
                  4.974356D+05           6.251402D-05
                  1.132027D+05           3.286553D-04
                  3.206333D+04           1.385697D-03
                  1.045962D+04           5.016217D-03
                  3.775506D+03           1.606931D-02
                  1.472040D+03           4.574242D-02
                  6.099331D+02           1.128544D-01
                  2.652634D+02           2.254344D-01
                  1.198607D+02           3.140461D-01
                  5.544891D+01           2.267819D-01
                  2.498372D+01           7.334069D-02
                  1.188056D+01           1.102474D-01
                  5.660311D+00           1.131358D-01
                  2.495703D+00           1.971295D-02
                  1.177866D+00          -4.719088D-04
                  5.200440D-01           1.861606D-04
                  1.159650D-01          -6.208598D-05
                  5.893800D-02           7.295314D-05
                  2.694600D-02          -6.362062D-06
            S    20   1.00
                  3.321857D+06          -4.503003D-06
                  4.974356D+05          -3.501295D-05
                  1.132027D+05          -1.841339D-04
                  3.206333D+04          -7.769216D-04
                  1.045962D+04          -2.819505D-03
                  3.775506D+03          -9.087486D-03
                  1.472040D+03          -2.627134D-02
                  6.099331D+02          -6.712726D-02
                  2.652634D+02          -1.451130D-01
                  1.198607D+02          -2.412483D-01
                  5.544891D+01          -2.416314D-01
                  2.498372D+01           3.067362D-02
                  1.188056D+01           4.970415D-01
                  5.660311D+00           4.958875D-01
                  2.495703D+00           9.181868D-02
                  1.177866D+00          -5.392514D-03
                  5.200440D-01           7.102380D-04
                  1.159650D-01          -6.363128D-04
                  5.893800D-02           5.979932D-04
                  2.694600D-02          -1.100879D-04
            S    20   1.00
                  3.321857D+06           9.320648D-07
                  4.974356D+05           7.249306D-06
                  1.132027D+05           3.811967D-05
                  3.206333D+04           1.610238D-04
                  1.045962D+04           5.852210D-04
                  3.775506D+03           1.897502D-03
                  1.472040D+03           5.550909D-03
                  6.099331D+02           1.460584D-02
                  2.652634D+02           3.342974D-02
                  1.198607D+02           6.235722D-02
                  5.544891D+01           7.312435D-02
                  2.498372D+01          -1.911472D-02
                  1.188056D+01          -2.817249D-01
                  5.660311D+00          -4.488151D-01
                  2.495703D+00           9.202696D-02
                  1.177866D+00           7.110117D-01
                  5.200440D-01           4.309274D-01
                  1.159650D-01           2.604589D-02
                  5.893800D-02          -1.101049D-02
                  2.694600D-02           4.106300D-03
            S    20   1.00
                  3.321857D+06          -2.158944D-07
                  4.974356D+05          -1.678519D-06
                  1.132027D+05          -8.831213D-06
                  3.206333D+04          -3.727769D-05
                  1.045962D+04          -1.356099D-04
                  3.775506D+03          -4.392351D-04
                  1.472040D+03          -1.286948D-03
                  6.099331D+02          -3.382149D-03
                  2.652634D+02          -7.765646D-03
                  1.198607D+02          -1.447985D-02
                  5.544891D+01          -1.715502D-02
                  2.498372D+01           4.610101D-03
                  1.188056D+01           6.827831D-02
                  5.660311D+00           1.161368D-01
                  2.495703D+00          -3.277049D-02
                  1.177866D+00          -2.280000D-01
                  5.200440D-01          -2.793991D-01
                  1.159650D-01           2.771165D-01
                  5.893800D-02           5.852999D-01
                  2.694600D-02           2.963946D-01
            S    20   1.00
                  3.321857D+06          -4.093416D-07
                  4.974356D+05          -3.258956D-06
                  1.132027D+05          -1.656390D-05
                  3.206333D+04          -7.316689D-05
                  1.045962D+04          -2.512784D-04
                  3.775506D+03          -8.732657D-04
                  1.472040D+03          -2.347654D-03
                  6.099331D+02          -6.853150D-03
                  2.652634D+02          -1.376420D-02
                  1.198607D+02          -3.084679D-02
                  5.544891D+01          -2.562208D-02
                  2.498372D+01          -1.005123D-02
                  1.188056D+01           1.795330D-01
                  5.660311D+00           1.522400D-01
                  2.495703D+00           9.483887D-02
                  1.177866D+00          -1.014876D+00
                  5.200440D-01           2.308810D-01
                  1.159650D-01           2.113321D+00
                  5.893800D-02          -1.253048D+00
                  2.694600D-02          -6.139502D-01
            S    1   1.00
                  2.694600D-02           1.000000D+00
            S    1   1.00
                  1.232000D-02           1.000000D+00
            P    16   1.00
                  1.327320D+04           4.300000D-05
                  3.142126D+03           3.840000D-04
                  1.020588D+03           2.210000D-03
                  3.904407D+02           9.678000D-03
                  1.655043D+02           3.393600D-02
                  7.532006D+01           9.591700D-02
                  3.605503D+01           2.088530D-01
                  1.780436D+01           3.306600D-01
                  9.002929D+00           3.323120D-01
                  4.594544D+00           1.581880D-01
                  2.276760D+00           2.225200D-02
                  1.101178D+00          -1.565000D-03
                  5.186380D-01          -1.353000D-03
                  2.005650D-01          -2.650000D-04
                  8.129100D-02           2.900000D-05
                  3.179500D-02          -1.100000D-05
            P    16   1.00
                  1.327320D+04          -1.500000D-05
                  3.142126D+03          -1.310000D-04
                  1.020588D+03          -7.550000D-04
                  3.904407D+02          -3.325000D-03
                  1.655043D+02          -1.181100D-02
                  7.532006D+01          -3.425600D-02
                  3.605503D+01          -7.736300D-02
                  1.780436D+01          -1.284560D-01
                  9.002929D+00          -1.350780D-01
                  4.594544D+00           2.083800D-02
                  2.276760D+00           3.204990D-01
                  1.101178D+00           4.602600D-01
                  5.186380D-01           2.953460D-01
                  2.005650D-01           4.904600D-02
                  8.129100D-02          -3.824000D-03
                  3.179500D-02           1.585000D-03
            P    16   1.00
                  1.327320D+04           4.000000D-06
                  3.142126D+03           3.200000D-05
                  1.020588D+03           1.830000D-04
                  3.904407D+02           8.020000D-04
                  1.655043D+02           2.862000D-03
                  7.532006D+01           8.287000D-03
                  3.605503D+01           1.887000D-02
                  1.780436D+01           3.130700D-02
                  9.002929D+00           3.366000D-02
                  4.594544D+00          -9.479000D-03
                  2.276760D+00          -9.231300D-02
                  1.101178D+00          -1.489890D-01
                  5.186380D-01          -8.364400D-02
                  2.005650D-01           2.493390D-01
                  8.129100D-02           5.805150D-01
                  3.179500D-02           3.223800D-01
            P    16   1.00
                  1.327320D+04           4.000000D-06
                  3.142126D+03           3.900000D-05
                  1.020588D+03           2.230000D-04
                  3.904407D+02           9.960000D-04
                  1.655043D+02           3.498000D-03
                  7.532006D+01           1.029600D-02
                  3.605503D+01           2.296200D-02
                  1.780436D+01           3.920800D-02
                  9.002929D+00           3.994300D-02
                  4.594544D+00          -7.121000D-03
                  2.276760D+00          -1.162250D-01
                  1.101178D+00          -1.694960D-01
                  5.186380D-01          -1.553740D-01
                  2.005650D-01           3.950220D-01
                  8.129100D-02           6.789080D-01
                  3.179500D-02           8.312200D-02
            P    1   1.00
                  3.179500D-02           1.000000D+00
            P    1   1.00
                  1.244000D-02           1.000000D+00
            D    8   1.00
                  7.761150D+01           3.595000D-03
                  2.291590D+01           2.521000D-02
                  8.279540D+00           9.478600D-02
                  3.309930D+00           2.303630D-01
                  1.358630D+00           3.528940D-01
                  5.413500D-01           3.704140D-01
                  2.023560D-01           2.457180D-01
                  6.756800D-02           6.099300D-02
            D    8   1.00
                  7.761150D+01          -3.818000D-03
                  2.291590D+01          -2.671700D-02
                  8.279540D+00          -1.036900D-01
                  3.309930D+00          -2.476890D-01
                  1.358630D+00          -3.115230D-01
                  5.413500D-01          -2.282700D-02
                  2.023560D-01           5.697260D-01
                  6.756800D-02           4.194930D-01
            D    1   1.00
                  6.756800D-02           1.000000D+00
            D    1   1.00
                  2.256000D-02           1.000000D+00
            F    2   1.00
                  1.748800D+00           3.900680D-01
                  4.057000D-01           8.008410D-01
            F    1   1.00
                  1.311200D-01           1.000000D+00
            ****
            -Cr     0
            S    20   1.00
                  6.177194D+06           4.128667D-06
                  9.249295D+05           3.210767D-05
                  2.104865D+05           1.688416D-04
                  5.962005D+04           7.128520D-04
                  1.945076D+04           2.589325D-03
                  7.022056D+03           8.377350D-03
                  2.738763D+03           2.441725D-02
                  1.135814D+03           6.365135D-02
                  4.950923D+02           1.427618D-01
                  2.247487D+02           2.541275D-01
                  1.053836D+02           3.009512D-01
                  5.019359D+01           1.766513D-01
                  2.224957D+01           6.936709D-02
                  1.098265D+01           1.179579D-01
                  5.383665D+00           8.916187D-02
                  2.343685D+00           1.103630D-02
                  1.105202D+00          -3.546048D-04
                  4.878480D-01           1.057311D-04
                  8.959900D-02           1.114640D-05
                  3.342300D-02           2.661387D-05
            S    20   1.00
                  6.177194D+06          -2.301772D-06
                  9.249295D+05          -1.789536D-05
                  2.104865D+05          -9.416174D-05
                  5.962005D+04          -3.975074D-04
                  1.945076D+04          -1.447025D-03
                  7.022056D+03          -4.694622D-03
                  2.738763D+03          -1.382387D-02
                  1.135814D+03          -3.674643D-02
                  4.950923D+02          -8.647185D-02
                  2.247487D+02          -1.696735D-01
                  1.053836D+02          -2.507089D-01
                  5.019359D+01          -1.961156D-01
                  2.224957D+01           1.457244D-01
                  1.098265D+01           5.466706D-01
                  5.383665D+00           3.979434D-01
                  2.343685D+00           5.277007D-02
                  1.105202D+00          -4.374537D-03
                  4.878480D-01           3.204035D-04
                  8.959900D-02          -5.142077D-05
                  3.342300D-02           1.584134D-04
            S    20   1.00
                  6.177194D+06           4.862957D-07
                  9.249295D+05           3.776645D-06
                  2.104865D+05           1.990664D-05
                  5.962005D+04           8.389164D-05
                  1.945076D+04           3.065706D-04
                  7.022056D+03           9.944107D-04
                  2.738763D+03           2.961959D-03
                  1.135814D+03           7.969473D-03
                  4.950923D+02           1.955017D-02
                  2.247487D+02           4.085035D-02
                  1.053836D+02           6.929003D-02
                  5.019359D+01           6.146984D-02
                  2.224957D+01          -6.981302D-02
                  1.098265D+01          -3.517597D-01
                  5.383665D+00          -3.828629D-01
                  2.343685D+00           2.676401D-01
                  1.105202D+00           7.175950D-01
                  4.878480D-01           3.020814D-01
                  8.959900D-02           7.749514D-03
                  3.342300D-02           2.696096D-04
            S    20   1.00
                  6.177194D+06          -1.102451D-07
                  9.249295D+05          -8.530233D-07
                  2.104865D+05          -4.520358D-06
                  5.962005D+04          -1.891612D-05
                  1.945076D+04          -6.974344D-05
                  7.022056D+03          -2.237867D-04
                  2.738763D+03          -6.754503D-04
                  1.135814D+03          -1.789346D-03
                  4.950923D+02          -4.477858D-03
                  2.247487D+02          -9.140144D-03
                  1.053836D+02          -1.610562D-02
                  5.019359D+01          -1.334870D-02
                  2.224957D+01           1.426027D-02
                  1.098265D+01           8.931690D-02
                  5.383665D+00           8.885279D-02
                  2.343685D+00          -6.368776D-02
                  1.105202D+00          -2.783262D-01
                  4.878480D-01          -1.830071D-01
                  8.959900D-02           6.790937D-01
                  3.342300D-02           4.672953D-01
            S    20   1.00
                  6.177194D+06           2.179893D-07
                  9.249295D+05           1.612940D-06
                  2.104865D+05           9.111842D-06
                  5.962005D+04           3.500645D-05
                  1.945076D+04           1.435315D-04
                  7.022056D+03           4.035896D-04
                  2.738763D+03           1.425177D-03
                  1.135814D+03           3.114009D-03
                  4.950923D+02           9.814449D-03
                  2.247487D+02           1.474698D-02
                  1.053836D+02           3.911512D-02
                  5.019359D+01           9.170888D-03
                  2.224957D+01           1.559878D-02
                  1.098265D+01          -2.816844D-01
                  5.383665D+00          -6.895261D-03
                  2.343685D+00          -1.769781D-01
                  1.105202D+00           1.443061D+00
                  4.878480D-01          -1.029318D+00
                  8.959900D-02          -1.307667D+00
                  3.342300D-02           1.503842D+00
            S    1   1.00
                  3.342300D-02           1.000000D+00
            S    1   1.00
                  1.247000D-02           1.000000D+00
            P    16   1.00
                  1.445420D+04           4.400000D-05
                  3.421676D+03           3.890000D-04
                  1.111387D+03           2.241000D-03
                  4.251918D+02           9.821000D-03
                  1.802623D+02           3.447100D-02
                  8.206117D+01           9.746000D-02
                  3.929726D+01           2.119850D-01
                  1.941959D+01           3.339900D-01
                  9.828899D+00           3.301370D-01
                  5.016810D+00           1.522270D-01
                  2.487091D+00           2.042500D-02
                  1.198780D+00          -1.360000D-03
                  5.586950D-01          -1.195000D-03
                  2.089240D-01          -1.970000D-04
                  8.460800D-02           2.300000D-05
                  3.325800D-02          -9.000000D-06
            P    16   1.00
                  1.445420D+04          -1.500000D-05
                  3.421676D+03          -1.350000D-04
                  1.111387D+03          -7.770000D-04
                  4.251918D+02          -3.427000D-03
                  1.802623D+02          -1.218900D-02
                  8.206117D+01          -3.538800D-02
                  3.929726D+01          -7.991500D-02
                  1.941959D+01          -1.323350D-01
                  9.828899D+00          -1.354010D-01
                  5.016810D+00           3.200800D-02
                  2.487091D+00           3.338490D-01
                  1.198780D+00           4.617730D-01
                  5.586950D-01           2.812900D-01
                  2.089240D-01           4.184300D-02
                  8.460800D-02          -4.002000D-03
                  3.325800D-02           1.521000D-03
            P    16   1.00
                  1.445420D+04           4.000000D-06
                  3.421676D+03           3.200000D-05
                  1.111387D+03           1.850000D-04
                  4.251918D+02           8.100000D-04
                  1.802623D+02           2.906000D-03
                  8.206117D+01           8.391000D-03
                  3.929726D+01           1.919300D-02
                  1.941959D+01           3.156400D-02
                  9.828899D+00           3.341700D-02
                  5.016810D+00          -1.290700D-02
                  2.487091D+00          -9.365900D-02
                  1.198780D+00          -1.499770D-01
                  5.586950D-01          -6.723400D-02
                  2.089240D-01           2.707590D-01
                  8.460800D-02           5.758070D-01
                  3.325800D-02           3.011210D-01
            P    16   1.00
                  1.445420D+04           4.000000D-06
                  3.421676D+03           4.000000D-05
                  1.111387D+03           2.290000D-04
                  4.251918D+02           1.019000D-03
                  1.802623D+02           3.602000D-03
                  8.206117D+01           1.055000D-02
                  3.929726D+01           2.370200D-02
                  1.941959D+01           3.998800D-02
                  9.828899D+00           4.043700D-02
                  5.016810D+00          -1.207400D-02
                  2.487091D+00          -1.189390D-01
                  1.198780D+00          -1.781000D-01
                  5.586950D-01          -1.238650D-01
                  2.089240D-01           4.297220D-01
                  8.460800D-02           6.507860D-01
                  3.325800D-02           6.417100D-02
            P    1   1.00
                  3.325800D-02           1.000000D+00
            P    1   1.00
                  1.307000D-02           1.000000D+00
            D    8   1.00
                  8.857680D+01           3.621000D-03
                  2.620450D+01           2.576600D-02
                  9.517470D+00           9.755600D-02
                  3.822480D+00           2.363120D-01
                  1.575120D+00           3.582860D-01
                  6.289280D-01           3.685430D-01
                  2.344240D-01           2.354940D-01
                  7.681500D-02           5.315600D-02
            D    8   1.00
                  8.857680D+01          -4.122000D-03
                  2.620450D+01          -2.930700D-02
                  9.517470D+00          -1.150620D-01
                  3.822480D+00          -2.730680D-01
                  1.575120D+00          -3.144230D-01
                  6.289280D-01           4.209700D-02
                  2.344240D-01           5.914030D-01
                  7.681500D-02           3.582150D-01
            D    1   1.00
                  7.681500D-02           1.000000D+00
            D    1   1.00
                  2.517000D-02           1.000000D+00
            F    2   1.00
                  2.221100D+00           4.235450D-01
                  5.231000D-01           7.741140D-01
            F    1   1.00
                  1.763600D-01           1.000000D+00
            ****
            -Mn     0
            S    20   1.00
                  3.960805D+06           8.242127D-06
                  5.931155D+05           6.408587D-05
                  1.349768D+05           3.369253D-04
                  3.823067D+04           1.420648D-03
                  1.247154D+04           5.143683D-03
                  4.501743D+03           1.648569D-02
                  1.755212D+03           4.698560D-02
                  7.273039D+02           1.162437D-01
                  3.163678D+02           2.335277D-01
                  1.430098D+02           3.292837D-01
                  6.621805D+01           2.440304D-01
                  2.991896D+01           7.219806D-02
                  1.430318D+01           7.687806D-02
                  6.839451D+00           7.852235D-02
                  3.012374D+00           1.294109D-02
                  1.418808D+00          -3.784873D-04
                  6.236240D-01          -2.503203D-05
                  1.340980D-01          -2.421517D-05
                  6.554800D-02           3.462071D-05
                  2.958400D-02           4.261482D-07
            S    20   1.00
                  3.960805D+06          -3.936095D-06
                  5.931155D+05          -3.060481D-05
                  1.349768D+05          -1.609626D-04
                  3.823067D+04          -6.792348D-04
                  1.247154D+04          -2.466182D-03
                  4.501743D+03          -7.957629D-03
                  1.755212D+03          -2.307248D-02
                  7.273039D+02          -5.932956D-02
                  3.163678D+02          -1.299451D-01
                  1.430098D+02          -2.212352D-01
                  6.621805D+01          -2.292550D-01
                  2.991896D+01           3.580733D-02
                  1.430318D+01           5.107602D-01
                  6.839451D+00           5.008307D-01
                  3.012374D+00           9.011830D-02
                  1.418808D+00          -6.909909D-03
                  6.236240D-01          -1.912925D-04
                  1.340980D-01          -6.032312D-04
                  6.554800D-02           5.621608D-04
                  2.958400D-02          -1.021109D-04
            S    20   1.00
                  3.960805D+06           9.462709D-07
                  5.931155D+05           7.360584D-06
                  1.349768D+05           3.869935D-05
                  3.823067D+04           1.635110D-04
                  1.247154D+04           5.941775D-04
                  4.501743D+03           1.927737D-03
                  1.755212D+03           5.641731D-03
                  7.273039D+02           1.487848D-02
                  3.163678D+02           3.414783D-02
                  1.430098D+02           6.405794D-02
                  6.621805D+01           7.557659D-02
                  2.991896D+01          -1.946070D-02
                  1.430318D+01          -2.957874D-01
                  6.839451D+00          -4.521170D-01
                  3.012374D+00           1.224531D-01
                  1.418808D+00           7.169756D-01
                  6.236240D-01           4.092712D-01
                  1.340980D-01           2.221969D-02
                  6.554800D-02          -9.011202D-03
                  2.958400D-02           3.691727D-03
            S    20   1.00
                  3.960805D+06          -2.095391D-07
                  5.931155D+05          -1.629439D-06
                  1.349768D+05          -8.570592D-06
                  3.823067D+04          -3.619272D-05
                  1.247154D+04          -1.316146D-04
                  4.501743D+03          -4.266810D-04
                  1.755212D+03          -1.250270D-03
                  7.273039D+02          -3.294665D-03
                  3.163678D+02          -7.581860D-03
                  1.430098D+02          -1.422864D-02
                  6.621805D+01          -1.693796D-02
                  2.991896D+01           4.454298D-03
                  1.430318D+01           6.867042D-02
                  6.839451D+00           1.113335D-01
                  3.012374D+00          -3.900820D-02
                  1.418808D+00          -2.215755D-01
                  6.236240D-01          -2.544359D-01
                  1.340980D-01           2.865866D-01
                  6.554800D-02           5.755741D-01
                  2.958400D-02           2.898778D-01
            S    20   1.00
                  3.960805D+06          -4.121231D-07
                  5.931155D+05          -3.282099D-06
                  1.349768D+05          -1.667433D-05
                  3.823067D+04          -7.369999D-05
                  1.247154D+04          -2.529495D-04
                  4.501743D+03          -8.801425D-04
                  1.755212D+03          -2.365482D-03
                  7.273039D+02          -6.926354D-03
                  3.163678D+02          -1.393851D-02
                  1.430098D+02          -3.143840D-02
                  6.621805D+01          -2.625749D-02
                  2.991896D+01          -1.048313D-02
                  1.430318D+01           1.856472D-01
                  6.839451D+00           1.524839D-01
                  3.012374D+00           7.411368D-02
                  1.418808D+00          -1.018097D+00
                  6.236240D-01           2.980372D-01
                  1.340980D-01           1.971989D+00
                  6.554800D-02          -1.179253D+00
                  2.958400D-02          -5.837703D-01
            S    1   1.00
                  2.958400D-02           1.000000D+00
            S    1   1.00
                  1.335000D-02           1.000000D+00
            P    16   1.00
                  1.620586D+04           4.200000D-05
                  3.836274D+03           3.730000D-04
                  1.246048D+03           2.149000D-03
                  4.767535D+02           9.445000D-03
                  2.021895D+02           3.329700D-02
                  9.209487D+01           9.475900D-02
                  4.414720D+01           2.081440D-01
                  2.185468D+01           3.318050D-01
                  1.108596D+01           3.331750D-01
                  5.674108D+00           1.576010D-01
                  2.823170D+00           2.144500D-02
                  1.368621D+00          -2.558000D-03
                  6.444310D-01          -2.027000D-03
                  2.483820D-01          -3.600000D-04
                  9.725500D-02           3.400000D-05
                  3.663300D-02          -1.300000D-05
            P    16   1.00
                  1.620586D+04          -1.500000D-05
                  3.836274D+03          -1.290000D-04
                  1.246048D+03          -7.480000D-04
                  4.767535D+02          -3.308000D-03
                  2.021895D+02          -1.181100D-02
                  9.209487D+01          -3.453300D-02
                  4.414720D+01          -7.878500D-02
                  2.185468D+01          -1.321830D-01
                  1.108596D+01          -1.371950D-01
                  5.674108D+00           2.707500D-02
                  2.823170D+00           3.288910D-01
                  1.368621D+00           4.572800D-01
                  6.444310D-01           2.889080D-01
                  2.483820D-01           4.743300D-02
                  9.725500D-02          -3.522000D-03
                  3.663300D-02           1.456000D-03
            P    16   1.00
                  1.620586D+04           3.000000D-06
                  3.836274D+03           3.000000D-05
                  1.246048D+03           1.720000D-04
                  4.767535D+02           7.620000D-04
                  2.021895D+02           2.726000D-03
                  9.209487D+01           7.976000D-03
                  4.414720D+01           1.828700D-02
                  2.185468D+01           3.077600D-02
                  1.108596D+01           3.237300D-02
                  5.674108D+00          -9.978000D-03
                  2.823170D+00          -9.052900D-02
                  1.368621D+00          -1.380040D-01
                  6.444310D-01          -7.796500D-02
                  2.483820D-01           2.295600D-01
                  9.725500D-02           5.761220D-01
                  3.663300D-02           3.485380D-01
            P    16   1.00
                  1.620586D+04           4.000000D-06
                  3.836274D+03           4.000000D-05
                  1.246048D+03           2.260000D-04
                  4.767535D+02           1.013000D-03
                  2.021895D+02           3.575000D-03
                  9.209487D+01           1.061200D-02
                  4.414720D+01           2.390200D-02
                  2.185468D+01           4.127900D-02
                  1.108596D+01           4.147500D-02
                  5.674108D+00          -9.458000D-03
                  2.823170D+00          -1.236950D-01
                  1.368621D+00          -1.743920D-01
                  6.444310D-01          -1.291700D-01
                  2.483820D-01           4.003480D-01
                  9.725500D-02           6.696460D-01
                  3.663300D-02           8.273200D-02
            P    1   1.00
                  3.663300D-02           1.000000D+00
            P    1   1.00
                  1.380000D-02           1.000000D+00
            D    8   1.00
                  1.006630D+02           3.579000D-03
                  2.983360D+01           2.582700D-02
                  1.088940D+01           9.855900D-02
                  4.393580D+00           2.383270D-01
                  1.817820D+00           3.587070D-01
                  7.278270D-01           3.650920D-01
                  2.712950D-01           2.337380D-01
                  8.830900D-02           5.661800D-02
            D    8   1.00
                  1.006630D+02          -3.454000D-03
                  2.983360D+01          -2.492500D-02
                  1.088940D+01          -9.763500D-02
                  4.393580D+00          -2.366920D-01
                  1.817820D+00          -2.923500D-01
                  7.278270D-01          -4.973000D-03
                  2.712950D-01           5.065880D-01
                  8.830900D-02           4.979510D-01
            D    1   1.00
                  8.830900D-02           1.000000D+00
            D    1   1.00
                  2.875000D-02           1.000000D+00
            F    2   1.00
                  2.703200D+00           4.267760D-01
                  6.438000D-01           7.697990D-01
            F    1   1.00
                  2.226000D-01           1.000000D+00
            ****
            -Fe     0
            S    20   1.00
                  4.316265D+06           8.048803D-06
                  6.463424D+05           6.258306D-05
                  1.470897D+05           3.290239D-04
                  4.166152D+04           1.387355D-03
                  1.359077D+04           5.023256D-03
                  4.905750D+03           1.610140D-02
                  1.912746D+03           4.590034D-02
                  7.926043D+02           1.136154D-01
                  3.448065D+02           2.283869D-01
                  1.558999D+02           3.221159D-01
                  7.223091D+01           2.383661D-01
                  3.272506D+01           7.404667D-02
                  1.566762D+01           9.214197D-02
                  7.503483D+00           9.339790D-02
                  3.312223D+00           1.573965D-02
                  1.558471D+00          -4.186682D-04
                  6.839140D-01           5.376318D-05
                  1.467570D-01          -3.816654D-05
                  7.058300D-02           4.319603D-05
                  3.144900D-02          -3.401019D-06
            S    20   1.00
                  4.316265D+06          -4.155954D-06
                  6.463424D+05          -3.231401D-05
                  1.470897D+05          -1.699525D-04
                  4.166152D+04          -7.171369D-04
                  1.359077D+04          -2.603625D-03
                  4.905750D+03          -8.399109D-03
                  1.912746D+03          -2.434109D-02
                  7.926043D+02          -6.251948D-02
                  3.448065D+02          -1.365929D-01
                  1.558999D+02          -2.312707D-01
                  7.223091D+01          -2.383734D-01
                  3.272506D+01           3.123837D-02
                  1.566762D+01           5.086818D-01
                  7.503483D+00           4.987695D-01
                  3.312223D+00           9.033552D-02
                  1.558471D+00          -6.005337D-03
                  6.839140D-01           2.312454D-04
                  1.467570D-01          -5.643680D-04
                  7.058300D-02           4.992260D-04
                  3.144900D-02          -1.015293D-04
            S    20   1.00
                  4.316265D+06           9.532178D-07
                  6.463424D+05           7.414605D-06
                  1.470897D+05           3.898393D-05
                  4.166152D+04           1.647152D-04
                  1.359077D+04           5.985980D-04
                  4.905750D+03           1.942390D-03
                  1.912746D+03           5.687237D-03
                  7.926043D+02           1.501329D-02
                  3.448065D+02           3.452455D-02
                  1.558999D+02           6.495820D-02
                  7.223091D+01           7.716194D-02
                  3.272506D+01          -1.873411D-02
                  1.566762D+01          -3.009185D-01
                  7.503483D+00          -4.554661D-01
                  3.312223D+00           1.286463D-01
                  1.558471D+00           7.183316D-01
                  6.839140D-01           4.051743D-01
                  1.467570D-01           2.168227D-02
                  7.058300D-02          -8.343566D-03
                  3.144900D-02           3.658979D-03
            S    20   1.00
                  4.316265D+06          -2.063008D-07
                  6.463424D+05          -1.604169D-06
                  1.470897D+05          -8.438437D-06
                  4.166152D+04          -3.563151D-05
                  1.359077D+04          -1.295998D-04
                  4.905750D+03          -4.201534D-04
                  1.912746D+03          -1.231954D-03
                  7.926043D+02          -3.248922D-03
                  3.448065D+02          -7.493717D-03
                  1.558999D+02          -1.410102D-02
                  7.223091D+01          -1.691600D-02
                  3.272506D+01           4.218996D-03
                  1.566762D+01           6.833810D-02
                  7.503483D+00           1.098201D-01
                  3.312223D+00          -4.009005D-02
                  1.558471D+00          -2.174739D-01
                  6.839140D-01          -2.465135D-01
                  1.467570D-01           2.731435D-01
                  7.058300D-02           5.748321D-01
                  3.144900D-02           3.012713D-01
            S    20   1.00
                  4.316265D+06          -4.009367D-07
                  6.463424D+05          -3.189255D-06
                  1.470897D+05          -1.623079D-05
                  4.166152D+04          -7.157920D-05
                  1.359077D+04          -2.463958D-04
                  4.905750D+03          -8.544907D-04
                  1.912746D+03          -2.307593D-03
                  7.926043D+02          -6.728292D-03
                  3.448065D+02          -1.366165D-02
                  1.558999D+02          -3.062240D-02
                  7.223091D+01          -2.631137D-02
                  3.272506D+01          -9.760183D-03
                  1.566762D+01           1.801906D-01
                  7.503483D+00           1.529634D-01
                  3.312223D+00           5.505413D-02
                  1.558471D+00          -9.551364D-01
                  6.839140D-01           2.586813D-01
                  1.467570D-01           1.834049D+00
                  7.058300D-02          -9.333240D-01
                  3.144900D-02          -6.981605D-01
            S    1   1.00
                  3.144900D-02           1.000000D+00
            S    1   1.00
                  1.401000D-02           1.000000D+00
            P    16   1.00
                  1.774569D+04           4.100000D-05
                  4.200721D+03           3.690000D-04
                  1.364429D+03           2.129000D-03
                  5.220806D+02           9.369000D-03
                  2.214595D+02           3.309700D-02
                  1.009096D+02           9.443100D-02
                  4.840115D+01           2.080770D-01
                  2.398536D+01           3.323330D-01
                  1.218250D+01           3.329870D-01
                  6.242298D+00           1.568430D-01
                  3.110944D+00           2.154900D-02
                  1.509958D+00          -2.095000D-03
                  7.108450D-01          -1.739000D-03
                  2.731900D-01          -3.000000D-04
                  1.042330D-01           2.900000D-05
                  3.829100D-02          -1.100000D-05
            P    16   1.00
                  1.774569D+04          -1.500000D-05
                  4.200721D+03          -1.300000D-04
                  1.364429D+03          -7.510000D-04
                  5.220806D+02          -3.329000D-03
                  2.214595D+02          -1.191200D-02
                  1.009096D+02          -3.493300D-02
                  4.840115D+01          -7.998900D-02
                  2.398536D+01          -1.346360D-01
                  1.218250D+01          -1.385980D-01
                  6.242298D+00           3.027800D-02
                  3.110944D+00           3.332160D-01
                  1.509958D+00           4.561530D-01
                  7.108450D-01           2.850510D-01
                  2.731900D-01           4.614400D-02
                  1.042330D-01          -3.249000D-03
                  3.829100D-02           1.357000D-03
            P    16   1.00
                  1.774569D+04           3.000000D-06
                  4.200721D+03           2.900000D-05
                  1.364429D+03           1.650000D-04
                  5.220806D+02           7.340000D-04
                  2.214595D+02           2.626000D-03
                  1.009096D+02           7.725000D-03
                  4.840115D+01           1.773300D-02
                  2.398536D+01           3.005500D-02
                  1.218250D+01           3.109400D-02
                  6.242298D+00          -1.004800D-02
                  3.110944D+00          -8.830600D-02
                  1.509958D+00          -1.298240D-01
                  7.108450D-01          -7.693700D-02
                  2.731900D-01           2.126610D-01
                  1.042330D-01           5.730610D-01
                  3.829100D-02           3.696510D-01
            P    16   1.00
                  1.774569D+04           5.000000D-06
                  4.200721D+03           4.200000D-05
                  1.364429D+03           2.410000D-04
                  5.220806D+02           1.085000D-03
                  2.214595D+02           3.831000D-03
                  1.009096D+02           1.142300D-02
                  4.840115D+01           2.579200D-02
                  2.398536D+01           4.481800D-02
                  1.218250D+01           4.459800D-02
                  6.242298D+00          -1.117700D-02
                  3.110944D+00          -1.381340D-01
                  1.509958D+00          -1.882850D-01
                  7.108450D-01          -1.073990D-01
                  2.731900D-01           4.448630D-01
                  1.042330D-01           6.402390D-01
                  3.829100D-02           6.445700D-02
            P    1   1.00
                  3.829100D-02           1.000000D+00
            P    1   1.00
                  1.407000D-02           1.000000D+00
            D    8   1.00
                  1.133440D+02           3.530000D-03
                  3.364140D+01           2.578400D-02
                  1.233100D+01           9.911900D-02
                  4.994780D+00           2.390730D-01
                  2.072800D+00           3.571990D-01
                  8.307530D-01           3.621880D-01
                  3.091780D-01           2.364610D-01
                  1.001300D-01           6.011800D-02
            D    8   1.00
                  1.133440D+02          -3.890000D-03
                  3.364140D+01          -2.844200D-02
                  1.233100D+01          -1.124290D-01
                  4.994780D+00          -2.742570D-01
                  2.072800D+00          -3.155460D-01
                  8.307530D-01           5.710900D-02
                  3.091780D-01           5.636040D-01
                  1.001300D-01           3.846370D-01
            D    1   1.00
                  1.001300D-01           1.000000D+00
            D    1   1.00
                  3.243000D-02           1.000000D+00
            F    2   1.00
                  3.224300D+00           4.222490D-01
                  7.758000D-01           7.714680D-01
            F    1   1.00
                  2.749000D-01           1.000000D+00
            ****
            -Co     0
            S    20   1.00
                  4.675675D+06           7.979026D-06
                  7.001615D+05           6.204071D-05
                  1.593373D+05           3.261735D-04
                  4.513046D+04           1.375360D-03
                  1.472238D+04           4.979997D-03
                  5.314222D+03           1.596434D-02
                  2.072018D+03           4.552086D-02
                  8.586188D+02           1.127385D-01
                  3.735497D+02           2.268262D-01
                  1.689229D+02           3.203074D-01
                  7.829639D+01           2.374021D-01
                  3.552123D+01           7.477686D-02
                  1.704144D+01           9.581872D-02
                  8.173000D+00           9.649911D-02
                  3.610318D+00           1.623362D-02
                  1.697047D+00          -4.535497D-04
                  7.435320D-01           5.113519D-05
                  1.583440D-01          -4.174508D-05
                  7.503600D-02           4.027577D-05
                  3.309100D-02          -5.789067D-06
            S    20   1.00
                  4.675675D+06          -4.200240D-06
                  7.001615D+05          -3.265831D-05
                  1.593373D+05          -1.717644D-04
                  4.513046D+04          -7.247853D-04
                  1.472238D+04          -2.631462D-03
                  5.314222D+03          -8.489272D-03
                  2.072018D+03          -2.460619D-02
                  8.586188D+02          -6.322059D-02
                  3.735497D+02          -1.381957D-01
                  1.689229D+02          -2.340680D-01
                  7.829639D+01          -2.415002D-01
                  3.552123D+01           3.035312D-02
                  1.704144D+01           5.101341D-01
                  8.173000D+00           4.974939D-01
                  3.610318D+00           8.970746D-02
                  1.697047D+00          -5.941034D-03
                  7.435320D-01           2.175362D-04
                  1.583440D-01          -5.480155D-04
                  7.503600D-02           4.525804D-04
                  3.309100D-02          -1.066748D-04
            S    20   1.00
                  4.675675D+06           9.592692D-07
                  7.001615D+05           7.461851D-06
                  1.593373D+05           3.923137D-05
                  4.513046D+04           1.657706D-04
                  1.472238D+04           6.024335D-04
                  5.314222D+03           1.955217D-03
                  2.072018D+03           5.726326D-03
                  8.586188D+02           1.512984D-02
                  3.735497D+02           3.483973D-02
                  1.689229D+02           6.570351D-02
                  7.829639D+01           7.831503D-02
                  3.552123D+01          -1.877037D-02
                  1.704144D+01          -3.062663D-01
                  8.173000D+00          -4.566429D-01
                  3.610318D+00           1.378169D-01
                  1.697047D+00           7.193676D-01
                  7.435320D-01           3.992579D-01
                  1.583440D-01           2.079933D-02
                  7.503600D-02          -7.820663D-03
                  3.309100D-02           3.533911D-03
            S    20   1.00
                  4.675675D+06          -2.028840D-07
                  7.001615D+05          -1.577580D-06
                  1.593373D+05          -8.298813D-06
                  4.513046D+04          -3.504154D-05
                  1.472238D+04          -1.274655D-04
                  5.314222D+03          -4.132695D-04
                  2.072018D+03          -1.212261D-03
                  8.586188D+02          -3.199318D-03
                  3.735497D+02          -7.390972D-03
                  1.689229D+02          -1.393649D-02
                  7.829639D+01          -1.678575D-02
                  3.552123D+01           4.149856D-03
                  1.704144D+01           6.797646D-02
                  8.173000D+00           1.075807D-01
                  3.610318D+00          -4.166022D-02
                  1.697047D+00          -2.128044D-01
                  7.435320D-01          -2.381360D-01
                  1.583440D-01           2.650788D-01
                  7.503600D-02           5.722774D-01
                  3.309100D-02           3.091556D-01
            S    20   1.00
                  4.675675D+06          -3.863053D-07
                  7.001615D+05          -3.068788D-06
                  1.593373D+05          -1.564826D-05
                  4.513046D+04          -6.883588D-05
                  1.472238D+04          -2.377367D-04
                  5.314222D+03          -8.213173D-04
                  2.072018D+03          -2.229630D-03
                  8.586188D+02          -6.467841D-03
                  3.735497D+02          -1.325463D-02
                  1.689229D+02          -2.946686D-02
                  7.829639D+01          -2.599066D-02
                  3.552123D+01          -8.499807D-03
                  1.704144D+01           1.727316D-01
                  8.173000D+00           1.512189D-01
                  3.610318D+00           3.554509D-02
                  1.697047D+00          -8.829353D-01
                  7.435320D-01           2.143530D-01
                  1.583440D-01           1.711865D+00
                  7.503600D-02          -7.140037D-01
                  3.309100D-02          -8.027727D-01
            S    1   1.00
                  3.309100D-02           1.000000D+00
            S    1   1.00
                  1.459000D-02           1.000000D+00
            P    16   1.00
                  1.926778D+04           4.100000D-05
                  4.560986D+03           3.690000D-04
                  1.481436D+03           2.128000D-03
                  5.668671D+02           9.372000D-03
                  2.404910D+02           3.315500D-02
                  1.096105D+02           9.475200D-02
                  5.259491D+01           2.090930D-01
                  2.608361D+01           3.337220D-01
                  1.326143D+01           3.322080D-01
                  6.799778D+00           1.546130D-01
                  3.393414D+00           2.090200D-02
                  1.648766D+00          -2.024000D-03
                  7.762820D-01          -1.697000D-03
                  2.980030D-01          -2.800000D-04
                  1.136180D-01           2.600000D-05
                  4.162400D-02          -1.000000D-05
            P    16   1.00
                  1.926778D+04          -1.500000D-05
                  4.560986D+03          -1.310000D-04
                  1.481436D+03          -7.580000D-04
                  5.668671D+02          -3.363000D-03
                  2.404910D+02          -1.205400D-02
                  1.096105D+02          -3.542400D-02
                  5.259491D+01          -8.128700D-02
                  2.608361D+01          -1.369080D-01
                  1.326143D+01          -1.390190D-01
                  6.799778D+00           3.546800D-02
                  3.393414D+00           3.384980D-01
                  1.648766D+00           4.544330D-01
                  7.762820D-01           2.797930D-01
                  2.980030D-01           4.477600D-02
                  1.136180D-01          -3.151000D-03
                  4.162400D-02           1.317000D-03
            P    16   1.00
                  1.926778D+04          -3.000000D-06
                  4.560986D+03          -2.900000D-05
                  1.481436D+03          -1.670000D-04
                  5.668671D+02          -7.420000D-04
                  2.404910D+02          -2.662000D-03
                  1.096105D+02          -7.841000D-03
                  5.259491D+01          -1.805100D-02
                  2.608361D+01          -3.058000D-02
                  1.326143D+01          -3.131200D-02
                  6.799778D+00           1.131100D-02
                  3.393414D+00           8.999000D-02
                  1.648766D+00           1.307330D-01
                  7.762820D-01           7.180800D-02
                  2.980030D-01          -2.216580D-01
                  1.136180D-01          -5.710250D-01
                  4.162400D-02          -3.637890D-01
            P    16   1.00
                  1.926778D+04           5.000000D-06
                  4.560986D+03           4.500000D-05
                  1.481436D+03           2.550000D-04
                  5.668671D+02           1.144000D-03
                  2.404910D+02           4.061000D-03
                  1.096105D+02           1.209500D-02
                  5.259491D+01           2.747600D-02
                  2.608361D+01           4.755700D-02
                  1.326143D+01           4.730200D-02
                  6.799778D+00          -1.441800D-02
                  3.393414D+00          -1.500620D-01
                  1.648766D+00          -1.990920D-01
                  7.762820D-01          -7.978300D-02
                  2.980030D-01           4.590350D-01
                  1.136180D-01           6.174950D-01
                  4.162400D-02           6.469000D-02
            P    1   1.00
                  4.162400D-02           1.000000D+00
            P    1   1.00
                  1.525000D-02           1.000000D+00
            D    8   1.00
                  1.262640D+02           3.510000D-03
                  3.752260D+01           2.588400D-02
                  1.380210D+01           1.000580D-01
                  5.609270D+00           2.405470D-01
                  2.333690D+00           3.568430D-01
                  9.364150D-01           3.595790D-01
                  3.482370D-01           2.366290D-01
                  1.123530D-01           6.212900D-02
            D    8   1.00
                  1.262640D+02          -4.067000D-03
                  3.752260D+01          -3.005300D-02
                  1.380210D+01          -1.196200D-01
                  5.609270D+00          -2.915130D-01
                  2.333690D+00          -3.180480D-01
                  9.364150D-01           9.169800D-02
                  3.482370D-01           5.608230D-01
                  1.123530D-01           3.586780D-01
            D    1   1.00
                  1.123530D-01           1.000000D+00
            D    1   1.00
                  3.625000D-02           1.000000D+00
            F    2   1.00
                  3.772400D+00           4.239660D-01
                  9.170000D-01           7.684290D-01
            F    1   1.00
                  3.271500D-01           1.000000D+00
            ****
            -Ni     0
            S    20   1.00
                  5.045991D+06           8.208996D-06
                  7.556142D+05           6.382884D-05
                  1.719568D+05           3.355800D-04
                  4.870479D+04           1.415075D-03
                  1.588841D+04           5.124444D-03
                  5.735123D+03           1.643256D-02
                  2.236137D+03           4.689398D-02
                  9.266468D+02           1.163534D-01
                  4.031743D+02           2.350511D-01
                  1.823476D+02           3.350184D-01
                  8.454885D+01           2.534779D-01
                  3.839634D+01           7.300901D-02
                  1.845859D+01           6.184244D-02
                  8.863548D+00           6.302956D-02
                  3.916227D+00           1.008063D-02
                  1.838870D+00          -2.244528D-04
                  8.043620D-01          -5.932767D-05
                  1.697970D-01          -1.158562D-05
                  7.930600D-02           8.115109D-06
                  3.467700D-02          -1.681699D-06
            S    20   1.00
                  5.045991D+06          -3.657849D-06
                  7.556142D+05          -2.844094D-05
                  1.719568D+05          -1.495928D-04
                  4.870479D+04          -6.313009D-04
                  1.588841D+04          -2.293052D-03
                  5.735123D+03          -7.405123D-03
                  2.236137D+03          -2.152032D-02
                  9.266468D+02          -5.560974D-02
                  4.031743D+02          -1.230176D-01
                  1.823476D+02          -2.130104D-01
                  8.454885D+01          -2.265837D-01
                  3.839634D+01           3.546796D-02
                  1.845859D+01           5.181697D-01
                  8.863548D+00           5.025630D-01
                  3.916227D+00           8.955674D-02
                  1.838870D+00          -7.031311D-03
                  8.043620D-01          -4.339167D-04
                  1.697970D-01          -5.831711D-04
                  7.930600D-02           4.228788D-04
                  3.467700D-02          -1.266714D-04
            S    20   1.00
                  5.045991D+06           9.594149D-07
                  7.556142D+05           7.462614D-06
                  1.719568D+05           3.923843D-05
                  4.870479D+04           1.657868D-04
                  1.588841D+04           6.025905D-04
                  5.735123D+03           1.955662D-03
                  2.236137D+03           5.730391D-03
                  9.266468D+02           1.514756D-02
                  4.031743D+02           3.493499D-02
                  1.823476D+02           6.598072D-02
                  8.454885D+01           7.893083D-02
                  3.839634D+01          -1.906249D-02
                  1.845859D+01          -3.095921D-01
                  8.863548D+00          -4.558610D-01
                  3.916227D+00           1.482931D-01
                  1.838870D+00           7.134039D-01
                  8.043620D-01           3.976063D-01
                  1.697970D-01           2.295523D-02
                  7.930600D-02          -9.151758D-03
                  3.467700D-02           3.875414D-03
            S    20   1.00
                  5.045991D+06          -2.013753D-07
                  7.556142D+05          -1.565832D-06
                  1.719568D+05          -8.237182D-06
                  4.870479D+04          -3.478105D-05
                  1.588841D+04          -1.265265D-04
                  5.735123D+03          -4.102589D-04
                  2.236137D+03          -1.203834D-03
                  9.266468D+02          -3.179062D-03
                  4.031743D+02          -7.353828D-03
                  1.823476D+02          -1.389022D-02
                  8.454885D+01          -1.677875D-02
                  3.839634D+01           4.163378D-03
                  1.845859D+01           6.814703D-02
                  8.863548D+00           1.061029D-01
                  3.916227D+00          -4.339980D-02
                  1.838870D+00          -2.094950D-01
                  8.043620D-01          -2.310271D-01
                  1.697970D-01           2.590532D-01
                  7.930600D-02           5.691426D-01
                  3.467700D-02           3.158125D-01
            S    20   1.00
                  5.045991D+06          -3.924245D-07
                  7.556142D+05          -3.113909D-06
                  1.719568D+05          -1.590447D-05
                  4.870479D+04          -6.981394D-05
                  1.588841D+04          -2.417848D-04
                  5.735123D+03          -8.326195D-04
                  2.236137D+03          -2.270294D-03
                  9.266468D+02          -6.557427D-03
                  4.031743D+02          -1.354288D-02
                  1.823476D+02          -2.989768D-02
                  8.454885D+01          -2.693106D-02
                  3.839634D+01          -7.827693D-03
                  1.845859D+01           1.741667D-01
                  8.863548D+00           1.595468D-01
                  3.916227D+00           1.995550D-02
                  1.838870D+00          -8.897000D-01
                  8.043620D-01           2.486892D-01
                  1.697970D-01           1.613012D+00
                  7.930600D-02          -5.990277D-01
                  3.467700D-02          -8.369078D-01
            S    1   1.00
                  3.467700D-02           1.000000D+00
            S    1   1.00
                  1.516000D-02           1.000000D+00
            P    16   1.00
                  2.102792D+04           4.100000D-05
                  4.977560D+03           3.630000D-04
                  1.616740D+03           2.097000D-03
                  6.186718D+02           9.250000D-03
                  2.625183D+02           3.279600D-02
                  1.196907D+02           9.400400D-02
                  5.746585D+01           2.082800D-01
                  2.852829D+01           3.336540D-01
                  1.452148D+01           3.329040D-01
                  7.453850D+00           1.553720D-01
                  3.723553D+00           2.085900D-02
                  1.809813D+00          -2.440000D-03
                  8.513360D-01          -1.998000D-03
                  3.248140D-01          -3.380000D-04
                  1.195220D-01           3.500000D-05
                  4.236600D-02          -1.200000D-05
            P    16   1.00
                  2.102792D+04          -1.500000D-05
                  4.977560D+03          -1.290000D-04
                  1.616740D+03          -7.490000D-04
                  6.186718D+02          -3.328000D-03
                  2.625183D+02          -1.194700D-02
                  1.196907D+02          -3.524200D-02
                  5.746585D+01          -8.120400D-02
                  2.852829D+01          -1.374930D-01
                  1.452148D+01          -1.392260D-01
                  7.453850D+00           3.601600D-02
                  3.723553D+00           3.391280D-01
                  1.809813D+00           4.504720D-01
                  8.513360D-01           2.817830D-01
                  3.248140D-01           4.789800D-02
                  1.195220D-01          -2.987000D-03
                  4.236600D-02           1.309000D-03
            P    16   1.00
                  2.102792D+04           3.000000D-06
                  4.977560D+03           2.600000D-05
                  1.616740D+03           1.520000D-04
                  6.186718D+02           6.780000D-04
                  2.625183D+02           2.427000D-03
                  1.196907D+02           7.201000D-03
                  5.746585D+01           1.657800D-02
                  2.852829D+01           2.839200D-02
                  1.452148D+01           2.859900D-02
                  7.453850D+00          -1.013200D-02
                  3.723553D+00          -8.291200D-02
                  1.809813D+00          -1.159980D-01
                  8.513360D-01          -7.279500D-02
                  3.248140D-01           1.956400D-01
                  1.195220D-01           5.670990D-01
                  4.236600D-02           3.952700D-01
            P    16   1.00
                  2.102792D+04           6.000000D-06
                  4.977560D+03           5.300000D-05
                  1.616740D+03           3.050000D-04
                  6.186718D+02           1.364000D-03
                  2.625183D+02           4.876000D-03
                  1.196907D+02           1.450300D-02
                  5.746585D+01           3.329600D-02
                  2.852829D+01           5.748200D-02
                  1.452148D+01           5.870200D-02
                  7.453850D+00          -1.990400D-02
                  3.723553D+00          -1.946950D-01
                  1.809813D+00          -2.396130D-01
                  8.513360D-01          -2.232000D-03
                  3.248140D-01           5.214350D-01
                  1.195220D-01           5.455400D-01
                  4.236600D-02           4.362200D-02
            P    1   1.00
                  4.236600D-02           1.000000D+00
            P    1   1.00
                  1.502000D-02           1.000000D+00
            D    8   1.00
                  1.402527D+02           3.376000D-03
                  4.172610D+01           2.514100D-02
                  1.539810D+01           9.774600D-02
                  6.277100D+00           2.347090D-01
                  2.618500D+00           3.469450D-01
                  1.052600D+00           3.510680D-01
                  3.916000D-01           2.502550D-01
                  1.262000D-01           1.000820D-01
            D    8   1.00
                  1.402527D+02          -3.495000D-03
                  4.172610D+01          -2.601500D-02
                  1.539810D+01          -1.038760D-01
                  6.277100D+00          -2.520700D-01
                  2.618500D+00          -2.945800D-01
                  1.052600D+00           1.152000D-03
                  3.916000D-01           4.385890D-01
                  1.262000D-01           5.436260D-01
            D    1   1.00
                  1.262000D-01           1.000000D+00
            D    1   1.00
                  4.067000D-02           1.000000D+00
            F    2   1.00
                  4.345500D+00           4.174290D-01
                  1.068000D+00           7.714830D-01
            F    1   1.00
                  4.083000D-01           1.000000D+00
            ****
            -Cu     0
            S    20   1.00
                  5.430321D+06           7.801026D-06
                  8.131665D+05           6.065666D-05
                  1.850544D+05           3.188964D-04
                  5.241466D+04           1.344687D-03
                  1.709868D+04           4.869050D-03
                  6.171994D+03           1.561013D-02
                  2.406481D+03           4.452077D-02
                  9.972584D+02           1.103111D-01
                  4.339289D+02           2.220342D-01
                  1.962869D+02           3.133739D-01
                  9.104280D+01           2.315121D-01
                  4.138425D+01           7.640920D-02
                  1.993278D+01           1.103818D-01
                  9.581891D+00           1.094372D-01
                  4.234516D+00           1.836311D-02
                  1.985814D+00          -6.043084D-04
                  8.670830D-01           5.092245D-05
                  1.813390D-01          -5.540730D-05
                  8.365700D-02           3.969482D-05
                  3.626700D-02          -1.269538D-05
            S    20   1.00
                  5.430321D+06          -4.404706D-06
                  8.131665D+05          -3.424801D-05
                  1.850544D+05          -1.801238D-04
                  5.241466D+04          -7.600455D-04
                  1.709868D+04          -2.759348D-03
                  6.171994D+03          -8.900970D-03
                  2.406481D+03          -2.579378D-02
                  9.972584D+02          -6.623861D-02
                  4.339289D+02          -1.445927D-01
                  1.962869D+02          -2.440110D-01
                  9.104280D+01          -2.504837D-01
                  4.138425D+01           2.852577D-02
                  1.993278D+01           5.115874D-01
                  9.581891D+00           4.928061D-01
                  4.234516D+00           8.788437D-02
                  1.985814D+00          -5.820281D-03
                  8.670830D-01           2.013508D-04
                  1.813390D-01          -5.182553D-04
                  8.365700D-02           3.731503D-04
                  3.626700D-02          -1.193171D-04
            S    20   1.00
                  5.430321D+06           9.704682D-07
                  8.131665D+05           7.549245D-06
                  1.850544D+05           3.968892D-05
                  5.241466D+04           1.677200D-04
                  1.709868D+04           6.095101D-04
                  6.171994D+03           1.978846D-03
                  2.406481D+03           5.798049D-03
                  9.972584D+02           1.534158D-02
                  4.339289D+02           3.540484D-02
                  1.962869D+02           6.702098D-02
                  9.104280D+01           8.026945D-02
                  4.138425D+01          -1.927231D-02
                  1.993278D+01          -3.160129D-01
                  9.581891D+00          -4.573162D-01
                  4.234516D+00           1.550841D-01
                  1.985814D+00           7.202872D-01
                  8.670830D-01           3.885122D-01
                  1.813390D-01           1.924326D-02
                  8.365700D-02          -7.103807D-03
                  3.626700D-02           3.272906D-03
            S    20   1.00
                  5.430321D+06          -1.959354D-07
                  8.131665D+05          -1.523472D-06
                  1.850544D+05          -8.014808D-06
                  5.241466D+04          -3.383992D-05
                  1.709868D+04          -1.231191D-04
                  6.171994D+03          -3.992085D-04
                  2.406481D+03          -1.171900D-03
                  9.972584D+02          -3.096141D-03
                  4.339289D+02          -7.171993D-03
                  1.962869D+02          -1.356621D-02
                  9.104280D+01          -1.643989D-02
                  4.138425D+01           4.107628D-03
                  1.993278D+01           6.693964D-02
                  9.581891D+00           1.028221D-01
                  4.234516D+00          -4.422945D-02
                  1.985814D+00          -2.031191D-01
                  8.670830D-01          -2.230022D-01
                  1.813390D-01           2.517975D-01
                  8.365700D-02           5.650091D-01
                  3.626700D-02           3.247243D-01
            S    20   1.00
                  5.430321D+06          -3.532229D-07
                  8.131665D+05          -2.798812D-06
                  1.850544D+05          -1.432517D-05
                  5.241466D+04          -6.270946D-05
                  1.709868D+04          -2.179490D-04
                  6.171994D+03          -7.474316D-04
                  2.406481D+03          -2.049271D-03
                  9.972584D+02          -5.885203D-03
                  4.339289D+02          -1.226885D-02
                  1.962869D+02          -2.683147D-02
                  9.104280D+01          -2.479261D-02
                  4.138425D+01          -5.984746D-03
                  1.993278D+01           1.557124D-01
                  9.581891D+00           1.436683D-01
                  4.234516D+00           8.374103D-03
                  1.985814D+00          -7.460711D-01
                  8.670830D-01           1.244367D-01
                  1.813390D-01           1.510110D+00
                  8.365700D-02          -3.477122D-01
                  3.626700D-02          -9.774169D-01
            S    1   1.00
                  3.626700D-02           1.000000D+00
            S    1   1.00
                  1.572000D-02           1.000000D+00
            P    16   1.00
                  2.276057D+04           4.000000D-05
                  5.387679D+03           3.610000D-04
                  1.749945D+03           2.083000D-03
                  6.696653D+02           9.197000D-03
                  2.841948D+02           3.266000D-02
                  1.296077D+02           9.379500D-02
                  6.225415D+01           2.082740D-01
                  3.092964D+01           3.339930D-01
                  1.575827D+01           3.324930D-01
                  8.094211D+00           1.547280D-01
                  4.046921D+00           2.127100D-02
                  1.967869D+00          -1.690000D-03
                  9.252950D-01          -1.516000D-03
                  3.529920D-01          -2.420000D-04
                  1.273070D-01           2.300000D-05
                  4.435600D-02          -9.000000D-06
            P    16   1.00
                  2.276057D+04          -1.500000D-05
                  5.387679D+03          -1.310000D-04
                  1.749945D+03          -7.550000D-04
                  6.696653D+02          -3.359000D-03
                  2.841948D+02          -1.208100D-02
                  1.296077D+02          -3.570300D-02
                  6.225415D+01          -8.250200D-02
                  3.092964D+01          -1.398900D-01
                  1.575827D+01          -1.407290D-01
                  8.094211D+00           3.876600D-02
                  4.046921D+00           3.426950D-01
                  1.967869D+00           4.523100D-01
                  9.252950D-01           2.770540D-01
                  3.529920D-01           4.388500D-02
                  1.273070D-01          -2.802000D-03
                  4.435600D-02           1.152000D-03
            P    16   1.00
                  2.276057D+04           3.000000D-06
                  5.387679D+03           2.500000D-05
                  1.749945D+03           1.470000D-04
                  6.696653D+02           6.560000D-04
                  2.841948D+02           2.351000D-03
                  1.296077D+02           7.004000D-03
                  6.225415D+01           1.613100D-02
                  3.092964D+01           2.777000D-02
                  1.575827D+01           2.756700D-02
                  8.094211D+00          -1.011500D-02
                  4.046921D+00          -8.100900D-02
                  1.967869D+00          -1.104090D-01
                  9.252950D-01          -7.173200D-02
                  3.529920D-01           1.879300D-01
                  1.273070D-01           5.646290D-01
                  4.435600D-02           4.070000D-01
            P    16   1.00
                  2.276057D+04           5.000000D-06
                  5.387679D+03           4.900000D-05
                  1.749945D+03           2.780000D-04
                  6.696653D+02           1.253000D-03
                  2.841948D+02           4.447000D-03
                  1.296077D+02           1.337000D-02
                  6.225415D+01           3.046900D-02
                  3.092964D+01           5.344700D-02
                  1.575827D+01           5.263900D-02
                  8.094211D+00          -1.688100D-02
                  4.046921D+00          -1.794480D-01
                  1.967869D+00          -2.095880D-01
                  9.252950D-01          -3.963300D-02
                  3.529920D-01           5.021300D-01
                  1.273070D-01           5.811110D-01
                  4.435600D-02           4.566600D-02
            P    1   1.00
                  4.435600D-02           1.000000D+00
            P    1   1.00
                  1.545000D-02           1.000000D+00
            D    8   1.00
                  1.738970D+02           2.700000D-03
                  5.188690D+01           2.090900D-02
                  1.934190D+01           8.440800D-02
                  7.975720D+00           2.139990D-01
                  3.398230D+00           3.359800D-01
                  1.409320D+00           3.573010D-01
                  5.488580D-01           2.645780D-01
                  1.901990D-01           1.039720D-01
            D    8   1.00
                  1.738970D+02          -3.363000D-03
                  5.188690D+01          -2.607900D-02
                  1.934190D+01          -1.082310D-01
                  7.975720D+00          -2.822170D-01
                  3.398230D+00          -3.471900D-01
                  1.409320D+00           2.671100D-02
                  5.488580D-01           4.920470D-01
                  1.901990D-01           4.384220D-01
            D    1   1.00
                  1.901990D-01           1.000000D+00
            D    1   1.00
                  6.591000D-02           1.000000D+00
            F    2   1.00
                  5.028600D+00           4.242800D-01
                  1.259400D+00           7.630250D-01
            F    1   1.00
                  4.617200D-01           1.000000D+00
            ****
            -Zn     0
            S    20   1.00
                  5.820021D+06           8.549241D-06
                  8.715234D+05           6.647410D-05
                  1.983350D+05           3.494962D-04
                  5.617631D+04           1.473832D-03
                  1.832582D+04           5.338330D-03
                  6.614955D+03           1.712708D-02
                  2.579199D+03           4.894085D-02
                  1.068849D+03           1.217934D-01
                  4.651045D+02           2.476589D-01
                  2.104130D+02           3.582431D-01
                  9.761629D+01           2.798174D-01
                  4.438020D+01           6.857491D-02
                  2.142308D+01          -1.311092D-03
                  1.030891D+01           1.914001D-03
                  4.553645D+00          -8.759220D-04
                  2.132821D+00           3.740096D-04
                  9.296970D-01          -1.401399D-04
                  1.921470D-01           4.757132D-05
                  8.759500D-02          -3.642711D-05
                  3.770200D-02           1.153248D-05
            S    20   1.00
                  5.820021D+06          -2.640069D-06
                  8.715234D+05          -2.052720D-05
                  1.983350D+05          -1.079859D-04
                  5.617631D+04          -4.558577D-04
                  1.832582D+04          -1.657758D-03
                  6.614955D+03          -5.368492D-03
                  2.579199D+03          -1.571249D-02
                  1.068849D+03          -4.122558D-02
                  4.651045D+02          -9.406459D-02
                  2.104130D+02          -1.719954D-01
                  9.761629D+01          -1.958523D-01
                  4.438020D+01           4.532907D-02
                  2.142308D+01           5.244442D-01
                  1.030891D+01           5.006142D-01
                  4.553645D+00           8.945527D-02
                  2.132821D+00          -2.146262D-03
                  9.296970D-01           2.112113D-03
                  1.921470D-01          -4.133980D-04
                  8.759500D-02           3.209752D-04
                  3.770200D-02          -1.016140D-04
            S    20   1.00
                  5.820021D+06           9.967103D-07
                  8.715234D+05           7.754163D-06
                  1.983350D+05           4.076019D-05
                  5.617631D+04           1.722811D-04
                  1.832582D+04           6.259370D-04
                  6.614955D+03           2.032855D-03
                  2.579199D+03           5.954646D-03
                  1.068849D+03           1.576640D-02
                  4.651045D+02           3.637638D-02
                  2.104130D+02           6.892343D-02
                  9.761629D+01           8.238093D-02
                  4.438020D+01          -2.011360D-02
                  2.142308D+01          -3.252526D-01
                  1.030891D+01          -4.602899D-01
                  4.553645D+00           1.635546D-01
                  2.132821D+00           7.297118D-01
                  9.296970D-01           3.769751D-01
                  1.921470D-01           1.433224D-02
                  8.759500D-02          -6.671210D-03
                  3.770200D-02           1.766214D-03
            S    20   1.00
                  5.820021D+06           1.995818D-07
                  8.715234D+05           1.552973D-06
                  1.983350D+05           8.161259D-06
                  5.617631D+04           3.450747D-05
                  1.832582D+04           1.253275D-04
                  6.614955D+03           4.072990D-04
                  2.579199D+03           1.192734D-03
                  1.068849D+03           3.163140D-03
                  4.651045D+02           7.303942D-03
                  2.104130D+02           1.391279D-02
                  9.761629D+01           1.670620D-02
                  4.438020D+01          -4.035586D-03
                  2.142308D+01          -6.968861D-02
                  1.030891D+01          -1.030105D-01
                  4.553645D+00           4.471442D-02
                  2.132821D+00           2.150027D-01
                  9.296970D-01           2.220163D-01
                  1.921470D-01          -3.114776D-01
                  8.759500D-02          -5.693429D-01
                  3.770200D-02          -2.678440D-01
            S    20   1.00
                  5.820021D+06          -5.435910D-07
                  8.715234D+05          -4.336894D-06
                  1.983350D+05          -2.197572D-05
                  5.617631D+04          -9.747392D-05
                  1.832582D+04          -3.331615D-04
                  6.614955D+03          -1.166192D-03
                  2.579199D+03          -3.119308D-03
                  1.068849D+03          -9.239504D-03
                  4.651045D+02          -1.855471D-02
                  2.104130D+02          -4.281189D-02
                  9.761629D+01          -3.571095D-02
                  4.438020D+01          -1.638350D-02
                  2.142308D+01           2.644664D-01
                  1.030891D+01           2.086588D-01
                  4.553645D+00          -1.774382D-02
                  2.132821D+00          -1.353873D+00
                  9.296970D-01           8.182926D-01
                  1.921470D-01           1.695036D+00
                  8.759500D-02          -1.388656D+00
                  3.770200D-02          -2.188900D-01
            S    1   1.00
                  3.770200D-02           1.000000D+00
            S    1   1.00
                  1.623000D-02           1.000000D+00
            P    16   1.00
                  2.441198D+04          -1.500000D-05
                  5.778518D+03          -1.350000D-04
                  1.876862D+03          -7.820000D-04
                  7.182361D+02          -3.478000D-03
                  3.048327D+02          -1.252000D-02
                  1.390453D+02          -3.701600D-02
                  6.680417D+01          -8.555900D-02
                  3.320699D+01          -1.447180D-01
                  1.692816D+01          -1.434420D-01
                  8.696229D+00           4.359500D-02
                  4.350510D+00           3.488880D-01
                  2.116523D+00           4.538650D-01
                  9.953870D-01           2.685940D-01
                  3.781120D-01           3.886800D-02
                  1.345790D-01          -2.492000D-03
                  4.628200D-02           1.014000D-03
            P    16   1.00
                  2.441198D+04           3.000000D-06
                  5.778518D+03           2.500000D-05
                  1.876862D+03           1.440000D-04
                  7.182361D+02           6.450000D-04
                  3.048327D+02           2.311000D-03
                  1.390453D+02           6.898000D-03
                  6.680417D+01           1.588200D-02
                  3.320699D+01           2.735000D-02
                  1.692816D+01           2.662100D-02
                  8.696229D+00          -1.085800D-02
                  4.350510D+00          -7.985300D-02
                  2.116523D+00          -1.061270D-01
                  9.953870D-01          -6.888300D-02
                  3.781120D-01           1.843850D-01
                  1.345790D-01           5.617880D-01
                  4.628200D-02           4.144160D-01
            P    16   1.00
                  2.441198D+04           5.000000D-06
                  5.778518D+03           4.200000D-05
                  1.876862D+03           2.380000D-04
                  7.182361D+02           1.088000D-03
                  3.048327D+02           3.821000D-03
                  1.390453D+02           1.164400D-02
                  6.680417D+01           2.616700D-02
                  3.320699D+01           4.675000D-02
                  1.692816D+01           4.330900D-02
                  8.696229D+00          -1.342900D-02
                  4.350510D+00          -1.538970D-01
                  2.116523D+00          -1.674130D-01
                  9.953870D-01          -8.499500D-02
                  3.781120D-01           4.508130D-01
                  1.345790D-01           6.408690D-01
                  4.628200D-02           5.417200D-02
            P    15   1.00
                  2.441198D+04           4.100000D-05
                  5.778518D+03           3.610000D-04
                  1.876862D+03           2.088000D-03
                  7.182361D+02           9.221000D-03
                  3.048327D+02           3.277300D-02
                  1.390453D+02           9.417900D-02
                  6.680417D+01           2.091320D-01
                  3.320699D+01           3.345690D-01
                  1.692816D+01           3.303590D-01
                  8.696229D+00           1.523470D-01
                  4.350510D+00           2.298400D-02
                  2.116523D+00           1.607000D-03
                  9.953870D-01           4.680000D-04
                  3.781120D-01           6.600000D-05
                  1.345790D-01          -2.000000D-06
            P    1   1.00
                  4.628200D-02           1.000000D+00
            P    1   1.00
                  1.592000D-02           1.000000D+00
            D    8   1.00
                  2.056177D+02           2.342000D-03
                  6.144981D+01           1.860600D-02
                  2.305689D+01           7.710200D-02
                  9.577739D+00           2.020260D-01
                  4.133734D+00           3.294540D-01
                  1.747518D+00           3.609760D-01
                  6.995600D-01           2.716570D-01
                  2.516080D-01           1.049810D-01
            D    8   1.00
                  2.056177D+02           3.279000D-03
                  6.144981D+01           2.617600D-02
                  2.305689D+01           1.113670D-01
                  9.577739D+00           3.045810D-01
                  4.133734D+00           3.862990D-01
                  1.747518D+00          -5.837500D-02
                  6.995600D-01          -5.388760D-01
                  2.516080D-01          -3.454730D-01
            D    1   1.00
                  2.516080D-01           1.000000D+00
            D    1   1.00
                  9.049000D-02           1.000000D+00
            F    2   1.00
                  5.734400D+00           4.311320D-01
                  1.461500D+00           7.546420D-01
            F    1   1.00
                  5.486100D-01           1.000000D+00
            ****
            -Ga     0
            S    14   1.00
                  4.851300D+05           2.068000D-04
                  7.271900D+04           1.604700D-03
                  1.655200D+04           8.340200D-03
                  4.687800D+03           3.402480D-02
                  1.529100D+03           1.111699D-01
                  5.518100D+02           2.753930D-01
                  2.151800D+02           4.212628D-01
                  8.817400D+01           2.738906D-01
                  2.715400D+01           2.837200D-02
                  1.150300D+01          -6.293100D-03
                  3.301800D+00           2.060600D-03
                  1.331400D+00          -9.269000D-04
                  1.931600D-01           2.273000D-04
                  7.089500D-02          -1.063000D-04
            S    14   1.00
                  4.851300D+05          -6.430000D-05
                  7.271900D+04          -4.954000D-04
                  1.655200D+04          -2.620800D-03
                  4.687800D+03          -1.068390D-02
                  1.529100D+03          -3.741230D-02
                  5.518100D+02          -1.009636D-01
                  2.151800D+02          -2.145141D-01
                  8.817400D+01          -1.752297D-01
                  2.715400D+01           4.831599D-01
                  1.150300D+01           6.323677D-01
                  3.301800D+00           6.849420D-02
                  1.331400D+00          -1.187120D-02
                  1.931600D-01           2.665200D-03
                  7.089500D-02          -1.225100D-03
            S    14   1.00
                  4.851300D+05           2.450000D-05
                  7.271900D+04           1.895000D-04
                  1.655200D+04           9.964000D-04
                  4.687800D+03           4.108200D-03
                  1.529100D+03           1.429380D-02
                  5.518100D+02           3.980340D-02
                  2.151800D+02           8.559400D-02
                  8.817400D+01           7.963050D-02
                  2.715400D+01          -2.939107D-01
                  1.150300D+01          -5.263914D-01
                  3.301800D+00           5.864249D-01
                  1.331400D+00           6.726347D-01
                  1.931600D-01           2.761230D-02
                  7.089500D-02          -9.365100D-03
            S    14   1.00
                  4.851300D+05          -5.700000D-06
                  7.271900D+04          -4.400000D-05
                  1.655200D+04          -2.305000D-04
                  4.687800D+03          -9.544000D-04
                  1.529100D+03          -3.305500D-03
                  5.518100D+02          -9.288800D-03
                  2.151800D+02          -1.986440D-02
                  8.817400D+01          -1.908880D-02
                  2.715400D+01           7.323560D-02
                  1.150300D+01           1.341526D-01
                  3.301800D+00          -1.831929D-01
                  1.331400D+00          -3.571308D-01
                  1.931600D-01           6.246013D-01
                  7.089500D-02           5.238430D-01
            S    1   1.00
                  7.089500D-02           1.000000D+00
            S    1   1.00
                  0.0243480              1.0000000
            P    11   1.00
                  3.248600D+03           1.526000D-03
                  7.699700D+02           1.274860D-02
                  2.482000D+02           6.337420D-02
                  9.336400D+01           2.065775D-01
                  3.825100D+01           4.092963D-01
                  1.642200D+01           3.919183D-01
                  6.791800D+00           1.029441D-01
                  2.833600D+00          -7.203000D-04
                  1.106200D+00           2.095000D-03
                  2.225000D-01          -3.290000D-04
                  6.177200D-02           1.162000D-04
            P    11   1.00
                  3.248600D+03          -5.803000D-04
                  7.699700D+02          -4.864700D-03
                  2.482000D+02          -2.483940D-02
                  9.336400D+01          -8.417590D-02
                  3.825100D+01          -1.800885D-01
                  1.642200D+01          -1.585555D-01
                  6.791800D+00           2.355376D-01
                  2.833600D+00           5.820587D-01
                  1.106200D+00           3.366619D-01
                  2.225000D-01           1.719120D-02
                  6.177200D-02          -3.326500D-03
            P    11   1.00
                  3.248600D+03           9.500000D-05
                  7.699700D+02           7.832000D-04
                  2.482000D+02           4.085500D-03
                  9.336400D+01           1.359870D-02
                  3.825100D+01           3.026950D-02
                  1.642200D+01           2.417900D-02
                  6.791800D+00          -4.237770D-02
                  2.833600D+00          -1.265661D-01
                  1.106200D+00          -4.994440D-02
                  2.225000D-01           4.494199D-01
                  6.177200D-02           6.718899D-01
            P    1   1.00
                  6.177200D-02           1.000000D+00
            P    1   1.00
                  0.0151640              1.0000000
            D    5   1.00
                  6.533700D+01           2.738250D-02
                  1.849700D+01           1.510805D-01
                  6.315000D+00           3.749217D-01
                  2.163500D+00           4.750799D-01
                  6.667500D-01           2.982750D-01
            D    1   1.00
                  1.884000D-01           1.000000D+00
            D    1   1.00
                  0.0537000              1.0000000
            ****
            -Ge     0
            S    14   1.00
                  5.218000D+05           2.045000D-04
                  7.821400D+04           1.586800D-03
                  1.780300D+04           8.248000D-03
                  5.041900D+03           3.366490D-02
                  1.644500D+03           1.101249D-01
                  5.934300D+02           2.735607D-01
                  2.313600D+02           4.210670D-01
                  9.476200D+01           2.766791D-01
                  2.927400D+01           2.921800D-02
                  1.245000D+01          -6.590300D-03
                  3.646300D+00           2.243000D-03
                  1.502500D+00          -1.038200D-03
                  2.450300D-01           2.695000D-04
                  9.159400D-02          -1.228000D-04
            S    14   1.00
                  5.218000D+05          -6.380000D-05
                  7.821400D+04          -4.916000D-04
                  1.780300D+04          -2.600200D-03
                  5.041900D+03          -1.060800D-02
                  1.644500D+03          -3.716020D-02
                  5.934300D+02          -1.005790D-01
                  2.313600D+02          -2.143977D-01
                  9.476200D+01          -1.782617D-01
                  2.927400D+01           4.777404D-01
                  1.245000D+01           6.355983D-01
                  3.646300D+00           7.221740D-02
                  1.502500D+00          -1.272650D-02
                  2.450300D-01           2.960800D-03
                  9.159400D-02          -1.329200D-03
            S    14   1.00
                  5.218000D+05           2.460000D-05
                  7.821400D+04           1.900000D-04
                  1.780300D+04           9.993000D-04
                  5.041900D+03           4.120000D-03
                  1.644500D+03           1.435570D-02
                  5.934300D+02           4.003750D-02
                  2.313600D+02           8.657940D-02
                  9.476200D+01           8.158610D-02
                  2.927400D+01          -2.934770D-01
                  1.245000D+01          -5.367983D-01
                  3.646300D+00           5.637985D-01
                  1.502500D+00           6.947182D-01
                  2.450300D-01           3.157300D-02
                  9.159400D-02          -9.894900D-03
            S    14   1.00
                  5.218000D+05          -6.300000D-06
                  7.821400D+04          -4.860000D-05
                  1.780300D+04          -2.553000D-04
                  5.041900D+03          -1.056000D-03
                  1.644500D+03          -3.667400D-03
                  5.934300D+02          -1.030530D-02
                  2.313600D+02          -2.222000D-02
                  9.476200D+01          -2.152750D-02
                  2.927400D+01           8.067520D-02
                  1.245000D+01           1.524958D-01
                  3.646300D+00          -1.980528D-01
                  1.502500D+00          -4.073954D-01
                  2.450300D-01           6.477288D-01
                  9.159400D-02           5.222033D-01
            S    1   1.00
                  9.159400D-02           1.000000D+00
            S    1   1.00
                  0.0339610              1.0000000
            P    11   1.00
                  3.568100D+03           1.459100D-03
                  8.457200D+02           1.221760D-02
                  2.727400D+02           6.104900D-02
                  1.026800D+02           2.008039D-01
                  4.214800D+01           4.038942D-01
                  1.814900D+01           3.970027D-01
                  7.593400D+00           1.105481D-01
                  3.196400D+00           7.680000D-05
                  1.274300D+00           2.126300D-03
                  2.825800D-01          -3.744000D-04
                  8.409000D-02           1.321000D-04
            P    11   1.00
                  3.568100D+03          -5.630000D-04
                  8.457200D+02          -4.735400D-03
                  2.727400D+02          -2.426430D-02
                  1.026800D+02          -8.309000D-02
                  4.214800D+01          -1.800247D-01
                  1.814900D+01          -1.663295D-01
                  7.593400D+00           2.193717D-01
                  3.196400D+00           5.820239D-01
                  1.274300D+00           3.477720D-01
                  2.825800D-01           1.924550D-02
                  8.409000D-02          -3.482500D-03
            P    11   1.00
                  3.568100D+03           1.115000D-04
                  8.457200D+02           9.212000D-04
                  2.727400D+02           4.827300D-03
                  1.026800D+02           1.622720D-02
                  4.214800D+01           3.663540D-02
                  1.814900D+01           3.078670D-02
                  7.593400D+00          -4.806430D-02
                  3.196400D+00          -1.559804D-01
                  1.274300D+00          -6.323700D-02
                  2.825800D-01           5.040819D-01
                  8.409000D-02           6.182200D-01
            P    1   1.00
                  8.409000D-02           1.000000D+00
            P    1   1.00
                  0.0239450              1.0000000
            D    5   1.00
                  7.476200D+01           2.576840D-02
                  2.130200D+01           1.454421D-01
                  7.343600D+00           3.713721D-01
                  2.565100D+00           4.800002D-01
                  8.197000D-01           2.896800D-01
            D    1   1.00
                  2.470000D-01           1.000000D+00
            D    1   1.00
                  0.0771000              1.0000000
            ****
            -As     0
            S    14   1.00
                  5.595838D+05           2.024000D-04
                  8.387933D+04           1.570900D-03
                  1.909267D+04           8.166200D-03
                  5.407392D+03           3.333990D-02
                  1.763756D+03           1.091726D-01
                  6.364567D+02           2.718853D-01
                  2.480884D+02           4.208509D-01
                  1.015785D+02           2.792257D-01
                  3.147551D+01           3.003010D-02
                  1.343728D+01          -6.880400D-03
                  4.008690D+00           2.424000D-03
                  1.684929D+00          -1.149100D-03
                  3.000190D-01           3.095000D-04
                  1.135870D-01          -1.377000D-04
            S    14   1.00
                  5.595838D+05          -6.340000D-05
                  8.387933D+04          -4.883000D-04
                  1.909267D+04          -2.582100D-03
                  5.407392D+03          -1.054020D-02
                  1.763756D+03          -3.693250D-02
                  6.364567D+02          -1.002355D-01
                  2.480884D+02          -2.142948D-01
                  1.015785D+02          -1.810526D-01
                  3.147551D+01           4.725410D-01
                  1.343728D+01           6.386194D-01
                  4.008690D+00           7.581070D-02
                  1.684929D+00          -1.352780D-02
                  3.000190D-01           3.197000D-03
                  1.135870D-01          -1.405600D-03
            S    14   1.00
                  5.595838D+05           2.460000D-05
                  8.387933D+04           1.907000D-04
                  1.909267D+04           1.003100D-03
                  5.407392D+03           4.135300D-03
                  1.763756D+03           1.442590D-02
                  6.364567D+02           4.029620D-02
                  2.480884D+02           8.756700D-02
                  1.015785D+02           8.351780D-02
                  3.147551D+01          -2.932935D-01
                  1.343728D+01          -5.470520D-01
                  4.008690D+00           5.438738D-01
                  1.684929D+00           7.143591D-01
                  3.000190D-01           3.534430D-02
                  1.135870D-01          -1.028920D-02
            S    14   1.00
                  5.595838D+05          -6.800000D-06
                  8.387933D+04          -5.250000D-05
                  1.909267D+04          -2.756000D-04
                  5.407392D+03          -1.138900D-03
                  1.763756D+03          -3.964600D-03
                  6.364567D+02          -1.114230D-02
                  2.480884D+02          -2.419910D-02
                  1.015785D+02          -2.363390D-02
                  3.147551D+01           8.663170D-02
                  1.343728D+01           1.685839D-01
                  4.008690D+00          -2.091425D-01
                  1.684929D+00          -4.500918D-01
                  3.000190D-01           6.603978D-01
                  1.135870D-01           5.284152D-01
            S    1   1.00
                  1.135870D-01           1.000000D+00
            S    1   1.00
                  0.0411520              1.0000000
            P    11   1.00
                  3.886356D+03           1.409700D-03
                  9.212020D+02           1.182770D-02
                  2.971932D+02           5.932800D-02
                  1.119751D+02           1.965115D-01
                  4.603462D+01           3.997891D-01
                  1.987419D+01           4.004653D-01
                  8.386088D+00           1.164196D-01
                  3.558728D+00           6.918000D-04
                  1.447282D+00           2.163300D-03
                  3.477790D-01          -4.150000D-04
                  1.076990D-01           1.452000D-04
            P    11   1.00
                  3.886356D+03          -5.519000D-04
                  9.212020D+02          -4.655000D-03
                  2.971932D+02          -2.391760D-02
                  1.119751D+02          -8.256270D-02
                  4.603462D+01          -1.806791D-01
                  1.987419D+01          -1.724848D-01
                  8.386088D+00           2.086700D-01
                  3.558728D+00           5.823622D-01
                  1.447282D+00           3.537465D-01
                  3.477790D-01           2.064390D-02
                  1.076990D-01          -3.638200D-03
            P    11   1.00
                  3.886356D+03           1.236000D-04
                  9.212020D+02           1.024000D-03
                  2.971932D+02           5.380500D-03
                  1.119751D+02           1.824430D-02
                  4.603462D+01           4.159790D-02
                  1.987419D+01           3.629980D-02
                  8.386088D+00          -5.235690D-02
                  3.558728D+00          -1.791667D-01
                  1.447282D+00          -7.404770D-02
                  3.477790D-01           5.358094D-01
                  1.076990D-01           5.888104D-01
            P    1   1.00
                  1.076990D-01           1.000000D+00
            P    1   1.00
                  0.0312680              1.0000000
            D    5   1.00
                  8.442423D+01           2.452880D-02
                  2.418159D+01           1.411340D-01
                  8.401777D+00           3.687579D-01
                  2.980502D+00           4.840626D-01
                  9.790030D-01           2.824434D-01
            D    1   1.00
                  3.098000D-01           1.000000D+00
            D    1   1.00
                  0.1078000              1.0000000
            ****
            -Se     0
            S    14   1.00
                  5.989900D+05           2.004000D-04
                  8.978300D+04           1.555400D-03
                  2.043500D+04           8.087200D-03
                  5.786900D+03           3.303440D-02
                  1.887300D+03           1.082924D-01
                  6.809700D+02           2.703361D-01
                  2.653900D+02           4.206236D-01
                  1.086300D+02           2.815922D-01
                  3.376000D+01           3.081100D-02
                  1.446500D+01          -7.161700D-03
                  4.389000D+00           2.602200D-03
                  1.878300D+00          -1.258300D-03
                  3.585900D-01           3.465000D-04
                  1.364900D-01          -1.503000D-04
            S    14   1.00
                  5.989900D+05          -6.290000D-05
                  8.978300D+04          -4.850000D-04
                  2.043500D+04          -2.564400D-03
                  5.786900D+03          -1.047610D-02
                  1.887300D+03          -3.672230D-02
                  6.809700D+02          -9.992250D-02
                  2.653900D+02          -2.141973D-01
                  1.086300D+02          -1.836593D-01
                  3.376000D+01           4.675454D-01
                  1.446500D+01           6.414740D-01
                  4.389000D+00           7.925690D-02
                  1.878300D+00          -1.426970D-02
                  3.585900D-01           3.379200D-03
                  1.364900D-01          -1.453700D-03
            S    14   1.00
                  5.989900D+05           2.470000D-05
                  8.978300D+04           1.913000D-04
                  2.043500D+04           1.006800D-03
                  5.786900D+03           4.151400D-03
                  1.887300D+03           1.449910D-02
                  6.809700D+02           4.056580D-02
                  2.653900D+02           8.853640D-02
                  1.086300D+02           8.542120D-02
                  3.376000D+01          -2.932581D-01
                  1.446500D+01          -5.570727D-01
                  4.389000D+00           5.261436D-01
                  1.878300D+00           7.320371D-01
                  3.585900D-01           3.882460D-02
                  1.364900D-01          -1.050360D-02
            S    14   1.00
                  5.989900D+05          -7.200000D-06
                  8.978300D+04          -5.590000D-05
                  2.043500D+04          -2.938000D-04
                  5.786900D+03          -1.213600D-03
                  1.887300D+03          -4.234000D-03
                  6.809700D+02          -1.190350D-02
                  2.653900D+02          -2.602060D-02
                  1.086300D+02          -2.561480D-02
                  3.376000D+01           9.194270D-02
                  1.446500D+01           1.838700D-01
                  4.389000D+00          -2.188461D-01
                  1.878300D+00          -4.896524D-01
                  3.585900D-01           6.775818D-01
                  1.364900D-01           5.296721D-01
            S    1   1.00
                  1.364900D-01           1.000000D+00
            S    1   1.00
                  0.0487470              1.0000000
            P    11   1.00
                  4.135600D+03           1.412700D-03
                  9.803400D+02           1.185880D-02
                  3.163500D+02           5.951530D-02
                  1.192500D+02           1.972201D-01
                  4.906800D+01           4.007439D-01
                  2.121200D+01           3.994740D-01
                  8.946200D+00           1.153364D-01
                  3.823600D+00           2.219000D-04
                  1.588300D+00           2.283800D-03
                  4.096900D-01          -4.756000D-04
                  1.245900D-01           1.516000D-04
            P    11   1.00
                  4.135600D+03          -5.610000D-04
                  9.803400D+02          -4.734000D-03
                  3.163500D+02          -2.435040D-02
                  1.192500D+02          -8.410710D-02
                  4.906800D+01          -1.841384D-01
                  2.121200D+01          -1.735004D-01
                  8.946200D+00           2.167263D-01
                  3.823600D+00           5.850099D-01
                  1.588300D+00           3.416816D-01
                  4.096900D-01           1.991250D-02
                  1.245900D-01          -2.613100D-03
            P    11   1.00
                  4.135600D+03           1.366000D-04
                  9.803400D+02           1.130800D-03
                  3.163500D+02           5.958100D-03
                  1.192500D+02           2.018660D-02
                  4.906800D+01           4.619390D-02
                  2.121200D+01           3.940500D-02
                  8.946200D+00          -5.928460D-02
                  3.823600D+00          -2.014663D-01
                  1.588300D+00          -6.878210D-02
                  4.096900D-01           5.595944D-01
                  1.245900D-01           5.709784D-01
            P    1   1.00
                  1.245900D-01           1.000000D+00
            P    1   1.00
                  0.0354920              1.0000000
            D    5   1.00
                  9.447200D+01           2.349820D-02
                  2.718000D+01           1.375183D-01
                  9.506800D+00           3.664824D-01
                  3.416800D+00           4.874717D-01
                  1.147900D+00           2.765769D-01
            D    1   1.00
                  3.682000D-01           1.000000D+00
            D    1   1.00
                  0.1283000              1.0000000
            ****
            -Br     0
            S    14   1.00
                  6.401000D+05           1.984000D-04
                  9.593800D+04           1.540000D-03
                  2.183300D+04           8.009600D-03
                  6.181900D+03           3.273410D-02
                  2.015700D+03           1.074480D-01
                  7.271000D+02           2.688946D-01
                  2.832800D+02           4.204411D-01
                  1.159100D+02           2.838041D-01
                  3.612400D+01           3.154550D-02
                  1.553200D+01          -7.426800D-03
                  4.785700D+00           2.772800D-03
                  2.081700D+00          -1.363500D-03
                  4.202800D-01           3.812000D-04
                  1.606900D-01          -1.615000D-04
            S    14   1.00
                  6.401000D+05          -6.250000D-05
                  9.593800D+04          -4.816000D-04
                  2.183300D+04          -2.546600D-03
                  6.181900D+03          -1.041120D-02
                  2.015700D+03          -3.651790D-02
                  7.271000D+02          -9.962950D-02
                  2.832800D+02          -2.141310D-01
                  1.159100D+02          -1.860911D-01
                  3.612400D+01           4.628261D-01
                  1.553200D+01           6.441141D-01
                  4.785700D+00           8.255020D-02
                  2.081700D+00          -1.496940D-02
                  4.202800D-01           3.528800D-03
                  1.606900D-01          -1.490900D-03
            S    14   1.00
                  6.401000D+05           2.480000D-05
                  9.593800D+04           1.919000D-04
                  2.183300D+04           1.010000D-03
                  6.181900D+03           4.165900D-03
                  2.015700D+03           1.456830D-02
                  7.271000D+02           4.083450D-02
                  2.832800D+02           8.948590D-02
                  1.159100D+02           8.727860D-02
                  3.612400D+01          -2.933644D-01
                  1.553200D+01          -5.667109D-01
                  4.785700D+00           5.105658D-01
                  2.081700D+00           7.477214D-01
                  4.202800D-01           4.215120D-02
                  1.606900D-01          -1.066120D-02
            S    14   1.00
                  6.401000D+05          -7.600000D-06
                  9.593800D+04          -5.880000D-05
                  2.183300D+04          -3.092000D-04
                  6.181900D+03          -1.276600D-03
                  2.015700D+03          -4.463400D-03
                  7.271000D+02          -1.255750D-02
                  2.832800D+02          -2.761450D-02
                  1.159100D+02          -2.739450D-02
                  3.612400D+01           9.640940D-02
                  1.553200D+01           1.976871D-01
                  4.785700D+00          -2.266693D-01
                  2.081700D+00          -5.241165D-01
                  4.202800D-01           6.889865D-01
                  1.606900D-01           5.344331D-01
            S    1   1.00
                  1.606900D-01           1.000000D+00
            S    1   1.00
                  0.0569460              1.0000000
            P    11   1.00
                  4.340800D+03           1.444800D-03
                  1.028900D+03           1.212880D-02
                  3.320200D+02           6.080770D-02
                  1.251600D+02           2.009358D-01
                  5.151100D+01           4.047419D-01
                  2.228100D+01           3.957151D-01
                  9.341700D+00           1.102213D-01
                  4.013200D+00          -9.090000D-04
                  1.700200D+00           2.483200D-03
                  4.719400D-01          -5.744000D-04
                  1.442100D-01           1.691000D-04
            P    11   1.00
                  4.340800D+03          -5.819000D-04
                  1.028900D+03          -4.906500D-03
                  3.320200D+02          -2.525140D-02
                  1.251600D+02          -8.694450D-02
                  5.151100D+01          -1.893422D-01
                  2.228100D+01          -1.710882D-01
                  9.341700D+00           2.368755D-01
                  4.013200D+00           5.898400D-01
                  1.700200D+00           3.171944D-01
                  4.719400D-01           1.798330D-02
                  1.442100D-01          -1.468300D-03
            P    11   1.00
                  4.340800D+03           1.518000D-04
                  1.028900D+03           1.256300D-03
                  3.320200D+02           6.622400D-03
                  1.251600D+02           2.238160D-02
                  5.151100D+01           5.097170D-02
                  2.228100D+01           4.140090D-02
                  9.341700D+00          -7.039700D-02
                  4.013200D+00          -2.232540D-01
                  1.700200D+00          -5.641790D-02
                  4.719400D-01           5.808079D-01
                  1.442100D-01           5.508132D-01
            P    1   1.00
                  1.442100D-01           1.000000D+00
            P    1   1.00
                  0.0410490              1.0000000
            D    5   1.00
                  1.048300D+02           2.265830D-02
                  3.027200D+01           1.345895D-01
                  1.064900D+01           3.647181D-01
                  3.869600D+00           4.904196D-01
                  1.323900D+00           2.713885D-01
            D    1   1.00
                  4.098000D-01           1.000000D+00
            D    1   1.00
                  0.1719000              1.0000000
            ****
            -Kr     0
            S    14   1.00
                  6.813588D+05           1.969000D-04
                  1.021265D+05           1.528600D-03
                  2.324371D+04           7.950000D-03
                  6.582007D+03           3.249380D-02
                  2.146429D+03           1.067240D-01
                  7.743378D+02           2.675701D-01
                  3.016702D+02           4.201851D-01
                  1.234118D+02           2.858015D-01
                  3.856755D+01           3.224610D-02
                  1.663738D+01          -7.682800D-03
                  5.198795D+00           2.939300D-03
                  2.294814D+00          -1.466200D-03
                  4.852110D-01           4.144000D-04
                  1.862700D-01          -1.720000D-04
            S    14   1.00
                  6.813588D+05          -6.220000D-05
                  1.021265D+05          -4.794000D-04
                  2.324371D+04          -2.534100D-03
                  6.582007D+03          -1.036360D-02
                  2.146429D+03          -3.635160D-02
                  7.743378D+02          -9.937370D-02
                  3.016702D+02          -2.140610D-01
                  1.234118D+02          -1.883192D-01
                  3.856755D+01           4.583816D-01
                  1.663738D+01           6.465664D-01
                  5.198795D+00           8.565790D-02
                  2.294814D+00          -1.561230D-02
                  4.852110D-01           3.649000D-03
                  1.862700D-01          -1.518900D-03
            S    14   1.00
                  6.813588D+05           2.490000D-05
                  1.021265D+05           1.928000D-04
                  2.324371D+04           1.014900D-03
                  6.582007D+03           4.185700D-03
                  2.146429D+03           1.464590D-02
                  7.743378D+02           4.110700D-02
                  3.016702D+02           9.039550D-02
                  1.234118D+02           8.906230D-02
                  3.856755D+01          -2.935718D-01
                  1.663738D+01          -5.759698D-01
                  5.198795D+00           4.968578D-01
                  2.294814D+00           7.616895D-01
                  4.852110D-01           4.532670D-02
                  1.862700D-01          -1.077220D-02
            S    14   1.00
                  6.813588D+05          -7.900000D-06
                  1.021265D+05          -6.140000D-05
                  2.324371D+04          -3.230000D-04
                  6.582007D+03          -1.333000D-03
                  2.146429D+03          -4.667200D-03
                  7.743378D+02          -1.313520D-02
                  3.016702D+02          -2.903420D-02
                  1.234118D+02          -2.901730D-02
                  3.856755D+01           1.002664D-01
                  1.663738D+01           2.103818D-01
                  5.198795D+00          -2.332471D-01
                  2.294814D+00          -5.546497D-01
                  4.852110D-01           6.969522D-01
                  1.862700D-01           5.408152D-01
            S    1   1.00
                  1.862700D-01           1.000000D+00
            S    1   1.00
                  0.0651450              1.0000000
            P    11   1.00
                  4.474270D+03           1.519500D-03
                  1.060579D+03           1.274240D-02
                  3.422081D+02           6.364650D-02
                  1.289984D+02           2.085635D-01
                  5.308722D+01           4.122423D-01
                  2.295942D+01           3.878103D-01
                  9.507300D+00           1.003820D-01
                  4.083055D+00          -2.507800D-03
                  1.750446D+00           2.713900D-03
                  5.291900D-01          -6.977000D-04
                  1.643690D-01           2.107000D-04
            P    11   1.00
                  4.474270D+03          -6.208000D-04
                  1.060579D+03          -5.221200D-03
                  3.422081D+02          -2.684630D-02
                  1.289984D+02          -9.158230D-02
                  5.308722D+01          -1.968164D-01
                  2.295942D+01          -1.634750D-01
                  9.507300D+00           2.738204D-01
                  4.083055D+00           5.981592D-01
                  1.750446D+00           2.750453D-01
                  5.291900D-01           1.277060D-02
                  1.643690D-01          -1.013500D-03
            P    11   1.00
                  4.474270D+03           1.701000D-04
                  1.060579D+03           1.406400D-03
                  3.422081D+02           7.396300D-03
                  1.289984D+02           2.482540D-02
                  5.308722D+01           5.571550D-02
                  2.295942D+01           4.121320D-02
                  9.507300D+00          -8.760570D-02
                  4.083055D+00          -2.440586D-01
                  1.750446D+00          -2.950070D-02
                  5.291900D-01           6.012295D-01
                  1.643690D-01           5.254807D-01
            P    1   1.00
                  1.643690D-01           1.000000D+00
            P    1   1.00
                  0.0466060              1.0000000
            D    5   1.00
                  1.155253D+02           2.195570D-02
                  3.346525D+01           1.321620D-01
                  1.183046D+01           3.633484D-01
                  4.339771D+00           4.929582D-01
                  1.507524D+00           2.667560D-01
            D    1   1.00
                  5.030000D-01           1.000000D+00
            D    1   1.00
                  0.2155000              1.0000000
            ****
            -Y     0
            S    7   1.00
                 29.2935000              0.0066660
                 16.6827000             -0.0497340
                 10.4235000              0.1315590
                  3.0952600             -0.5243820
                  0.7079710              0.7863790
                  0.3225670              0.4639580
                  0.0690850              0.0204860
            S    7   1.00
                 29.2935000             -0.0013580
                 16.6827000              0.0123920
                 10.4235000             -0.0375720
                  3.0952600              0.1741090
                  0.7079710             -0.3385090
                  0.3225670             -0.3354170
                  0.0690850              0.6581470
            S    7   1.00
                 29.2935000              0.0112420
                 16.6827000             -0.0574010
                 10.4235000              0.1106480
                  3.0952600             -0.3769430
                  0.7079710              1.2026360
                  0.3225670             -0.4875820
                  0.0690850             -1.8636390
            S    1   1.00
                  0.0274150              1.0000000
            S    1   1.00
                  0.0109000              1.0000000
            P    6   1.00
                  9.0271500              0.0203960
                  4.0242700             -0.1536620
                  0.9906740              0.4320820
                  0.4727970              0.4983480
                  0.2197340              0.1957420
                  0.0800880              0.0140830
            P    6   1.00
                  9.0271500             -0.0056190
                  4.0242700              0.0465110
                  0.9906740             -0.1495270
                  0.4727970             -0.2243370
                  0.2197340             -0.0114700
                  0.0800880              0.6364970
            P    6   1.00
                  9.0271500              0.0111310
                  4.0242700             -0.0963010
                  0.9906740              0.2986850
                  0.4727970              0.8892190
                  0.2197340             -1.4854780
                  0.0800880             -0.1131120
            P    1   1.00
                  0.0306400              1.0000000
            P    1   1.00
                  0.0117000              1.0000000
            D    5   1.00
                  4.3045000             -0.0043910
                  1.3201900              0.1196820
                  0.5614050              0.2962740
                  0.2267020              0.3908730
                  0.0879490              0.3539610
            D    5   1.00
                  4.3045000              0.0044330
                  1.3201900             -0.1499100
                  0.5614050             -0.3732930
                  0.2267020             -0.3129870
                  0.0879490              0.4218970
            D    1   1.00
                  0.0323050              1.0000000
            D    1   1.00
                  0.0119000              1.0000000
            F    1   1.00
                  0.2028000              1.0000000
            F    1   1.00
                  0.0484000              1.0000000
            ****
            -Zr     0
            S    7   1.00
                 53.4460000              0.0014860
                 17.0981000             -0.0365920
                 10.6875000              0.1321550
                  3.3913400             -0.5464540
                  0.7884750              0.8022910
                  0.3599820              0.4583040
                  0.0777920              0.0203880
            S    7   1.00
                 53.4460000             -0.0003080
                 17.0981000              0.0096310
                 10.6875000             -0.0390430
                  3.3913400              0.1847170
                  0.7884750             -0.3584690
                  0.3599820             -0.3208280
                  0.0777920              0.6560480
            S    7   1.00
                 53.4460000              0.0028110
                 17.0981000             -0.0412920
                 10.6875000              0.1148910
                  3.3913400             -0.4348090
                  0.7884750              1.4174320
                  0.3599820             -0.7286190
                  0.0777920             -1.6769590
            S    1   1.00
                  0.0302340              1.0000000
            S    1   1.00
                  0.0118000              1.0000000
            P    6   1.00
                  9.9011600              0.0214360
                  4.4181900             -0.1604130
                  1.0931000              0.4543260
                  0.5187860              0.4991190
                  0.2363630              0.1777830
                  0.0847070              0.0104040
            P    6   1.00
                  9.9011600             -0.0058310
                  4.4181900              0.0481520
                  1.0931000             -0.1600800
                  0.5187860             -0.2201350
                  0.2363630              0.0355150
                  0.0847070              0.6181780
            P    6   1.00
                  9.9011600             -0.0078290
                  4.4181900              0.0660080
                  1.0931000             -0.2113740
                  0.5187860             -0.3575490
                  0.2363630              0.1703870
                  0.0847070              0.8518400
            P    1   1.00
                  0.0311380              1.0000000
            P    1   1.00
                  0.0114000              1.0000000
            D    5   1.00
                  4.3948700             -0.0082920
                  1.5708900              0.1278490
                  0.6923540              0.3219090
                  0.2904140              0.3998190
                  0.1158780              0.3194760
            D    5   1.00
                  4.3948700              0.0084760
                  1.5708900             -0.1579890
                  0.6923540             -0.3979000
                  0.2904140             -0.2555990
                  0.1158780              0.4914180
            D    1   1.00
                  0.0429250              1.0000000
            D    1   1.00
                  0.0159000              1.0000000
            F    1   1.00
                  0.3272000              1.0000000
            F    1   1.00
                  0.0891000              1.0000000
            ****
            -Nb     0
            S    7   1.00
                 80.8096000              0.0008890
                 17.9220000             -0.0347930
                 11.2050000              0.1389100
                  3.6990100             -0.5655680
                  0.8712090              0.8147210
                  0.3974440              0.4547970
                  0.0854690              0.0200510
            S    7   1.00
                 80.8096000             -0.0002000
                 17.9220000              0.0093020
                 11.2050000             -0.0414910
                  3.6990100              0.1923710
                  0.8712090             -0.3713520
                  0.3974440             -0.3068350
                  0.0854690              0.6546160
            S    7   1.00
                 80.8096000              0.0015640
                 17.9220000             -0.0382840
                 11.2050000              0.1209450
                  3.6990100             -0.4647790
                  0.8712090              1.5031600
                  0.3974440             -0.8262330
                  0.0854690             -1.5845850
            S    1   1.00
                  0.0326640              1.0000000
            S    1   1.00
                  0.0125000              1.0000000
            P    6   1.00
                 10.6457000              0.0234360
                  4.8235100             -0.1683110
                  1.2030900              0.4693810
                  0.5695080              0.4980520
                  0.2569700              0.1675400
                  0.0929460              0.0087660
            P    6   1.00
                 10.6457000             -0.0064960
                  4.8235100              0.0513810
                  1.2030900             -0.1706080
                  0.5695080             -0.2198720
                  0.2569700              0.0561670
                  0.0929460              0.6165950
            P    6   1.00
                 10.6457000             -0.0091300
                  4.8235100              0.0732300
                  1.2030900             -0.2370360
                  0.5695080             -0.3685640
                  0.2569700              0.2364390
                  0.0929460              0.8267330
            P    1   1.00
                  0.0338800              1.0000000
            P    1   1.00
                  0.0123000              1.0000000
            D    5   1.00
                  4.5456300             -0.0104650
                  1.8272300              0.1305530
                  0.8257640              0.3347580
                  0.3551560              0.4020270
                  0.1447240              0.3008350
            D    5   1.00
                  4.5456300              0.0105280
                  1.8272300             -0.1615000
                  0.8257640             -0.4113720
                  0.3551560             -0.2117820
                  0.1447240              0.4861590
            D    1   1.00
                  0.0543230              1.0000000
            D    1   1.00
                  0.0204000              1.0000000
            F    1   1.00
                  0.4690000              1.0000000
            F    1   1.00
                  0.1387000              1.0000000
            ****
            -Mo     0
            S    7   1.00
                106.9780000              0.0007350
                 18.8824000             -0.0350900
                 11.8077000              0.1473480
                  4.0211800             -0.5833630
                  0.9568160              0.8256350
                  0.4356920              0.4523110
                  0.0925180              0.0190550
            S    7   1.00
                106.9780000             -0.0001760
                 18.8824000              0.0093320
                 11.8077000             -0.0438110
                  4.0211800              0.1972320
                  0.9568160             -0.3773110
                  0.4356920             -0.2939670
                  0.0925180              0.6498330
            S    7   1.00
                106.9780000              0.0011660
                 18.8824000             -0.0376070
                 11.8077000              0.1259800
                  4.0211800             -0.4752370
                  0.9568160              1.4989830
                  0.4356920             -0.8223450
                  0.0925180             -1.5606240
            S    1   1.00
                  0.0348540              1.0000000
            S    1   1.00
                  0.0131000              1.0000000
            P    6   1.00
                 11.4118000              0.0253450
                  5.2453500             -0.1752130
                  1.3188400              0.4812720
                  0.6229830              0.4972610
                  0.2791080              0.1595550
                  0.1005260              0.0075430
            P    6   1.00
                 11.4118000             -0.0070220
                  5.2453500              0.0533390
                  1.3188400             -0.1756430
                  0.6229830             -0.2162130
                  0.2791080              0.0679580
                  0.1005260              0.6128160
            P    6   1.00
                 11.4118000             -0.0104200
                  5.2453500              0.0798670
                  1.3188400             -0.2629000
                  0.6229830             -0.3651840
                  0.2791080              0.2866730
                  0.1005260              0.8002580
            P    1   1.00
                  0.0362770              1.0000000
            P    1   1.00
                  0.0131000              1.0000000
            D    5   1.00
                  5.2576100             -0.0147610
                  2.1046200              0.1319820
                  0.9582010              0.3470860
                  0.4140470              0.4054710
                  0.1684500              0.2880580
            D    5   1.00
                  5.2576100              0.0154390
                  2.1046200             -0.1606210
                  0.9582010             -0.4232290
                  0.4140470             -0.1923390
                  0.1684500              0.5314590
            D    1   1.00
                  0.0623420              1.0000000
            D    1   1.00
                  0.0231000              1.0000000
            F    1   1.00
                  0.6007000              1.0000000
            F    1   1.00
                  0.1850000              1.0000000
            ****
            -Tc     0
            S    7   1.00
                132.6560000              0.0006860
                 19.8986000             -0.0360010
                 12.4450000              0.1564650
                  4.3605000             -0.5995730
                  1.0443600              0.8357100
                  0.4741590              0.4490550
                  0.0987360              0.0183780
            S    7   1.00
                132.6560000             -0.0001680
                 19.8986000              0.0093110
                 12.4450000             -0.0455350
                  4.3605000              0.1986020
                  1.0443600             -0.3749740
                  0.4741590             -0.2817600
                  0.0987360              0.6329980
            S    7   1.00
                132.6560000              0.0009800
                 19.8986000             -0.0378410
                 12.4450000              0.1317670
                  4.3605000             -0.4834180
                  1.0443600              1.4848540
                  0.4741590             -0.8047310
                  0.0987360             -1.5511910
            S    1   1.00
                  0.0367360              1.0000000
            S    1   1.00
                  0.0137000              1.0000000
            P    6   1.00
                 12.1789000              0.0273140
                  5.6848400             -0.1814030
                  1.4398300              0.4908910
                  0.6789090              0.4965410
                  0.3025150              0.1532990
                  0.1073070              0.0067000
            P    6   1.00
                 12.1789000             -0.0074300
                  5.6848400              0.0541370
                  1.4398300             -0.1762270
                  0.6789090             -0.2096540
                  0.3025150              0.0734980
                  0.1073070              0.6070490
            P    6   1.00
                 12.1789000             -0.0116300
                  5.6848400              0.0854050
                  1.4398300             -0.2844050
                  0.6789090             -0.3578760
                  0.3025150              0.3260330
                  0.1073070              0.7801240
            P    1   1.00
                  0.0381770              1.0000000
            P    1   1.00
                  0.0136000              1.0000000
            D    5   1.00
                  5.7601300             -0.0164110
                  2.3642400              0.1344070
                  1.0887100              0.3547260
                  0.4740600              0.4044790
                  0.1936070              0.2788770
            D    5   1.00
                  5.7601300              0.0169910
                  2.3642400             -0.1548960
                  1.0887100             -0.4281920
                  0.4740600             -0.1789920
                  0.1936070              0.5346560
            D    1   1.00
                  0.0714600              1.0000000
            D    1   1.00
                  0.0264000              1.0000000
            F    1   1.00
                  0.7228000              1.0000000
            F    1   1.00
                  0.2272000              1.0000000
            ****
            -Ru     0
            S    7   1.00
                159.3720000              0.0006730
                 20.9016000             -0.0371610
                 13.0741000              0.1665170
                  4.7147400             -0.6159540
                  1.1361200              0.8428300
                  0.5154640              0.4477630
                  0.1067670              0.0184450
            S    7   1.00
                159.3720000             -0.0001690
                 20.9016000              0.0093920
                 13.0741000             -0.0477130
                  4.7147400              0.2011130
                  1.1361200             -0.3734210
                  0.5154640             -0.2738590
                  0.1067670              0.6093840
            S    7   1.00
                159.3720000              0.0008950
                 20.9016000             -0.0396350
                 13.0741000              0.1442430
                  4.7147400             -0.5192870
                  1.1361200              1.5854040
                  0.5154640             -0.9082030
                  0.1067670             -1.4720020
            S    1   1.00
                  0.0392180              1.0000000
            S    1   1.00
                  0.0144000              1.0000000
            P    6   1.00
                 12.8738000              0.0299680
                  6.1475000             -0.1879300
                  1.5652400              0.4999900
                  0.7361940              0.4957320
                  0.3263170              0.1475150
                  0.1124070              0.0060880
            P    6   1.00
                 12.8738000             -0.0078010
                  6.1475000              0.0536560
                  1.5652400             -0.1719400
                  0.7361940             -0.1991700
                  0.3263170              0.0744110
                  0.1124070              0.5971370
            P    6   1.00
                 12.8738000             -0.0135020
                  6.1475000              0.0937330
                  1.5652400             -0.3159100
                  0.7361940             -0.3618000
                  0.3263170              0.4008770
                  0.1124070              0.7537660
            P    1   1.00
                  0.0391720              1.0000000
            P    1   1.00
                  0.0137000              1.0000000
            D    5   1.00
                  6.2126500             -0.0245970
                  2.7853900              0.1273340
                  1.2685100              0.3570810
                  0.5517900              0.4082070
                  0.2247310              0.2812400
            D    5   1.00
                  6.2126500              0.0261160
                  2.7853900             -0.1459400
                  1.2685100             -0.4425210
                  0.5517900             -0.1690200
                  0.2247310              0.5052370
            D    1   1.00
                  0.0824110              1.0000000
            D    1   1.00
                  0.0302000              1.0000000
            F    1   1.00
                  0.8500000              1.0000000
            F    1   1.00
                  0.2719000              1.0000000
            ****
            -Rh     0
            S    7   1.00
                184.6660000              0.0006920
                 21.9974000             -0.0383930
                 13.7616000              0.1760190
                  5.0872000             -0.6299250
                  1.2294000              0.8495440
                  0.5568140              0.4457290
                  0.1140670              0.0182040
            S    7   1.00
                184.6660000             -0.0001780
                 21.9974000              0.0094560
                 13.7616000             -0.0494720
                  5.0872000              0.2018670
                  1.2294000             -0.3698090
                  0.5568140             -0.2653310
                  0.1140670              0.5891540
            S    7   1.00
                184.6660000              0.0008370
                 21.9974000             -0.0402860
                 13.7616000              0.1506490
                  5.0872000             -0.5268510
                  1.2294000              1.5723820
                  0.5568140             -0.8876430
                  0.1140670             -1.4709450
            S    1   1.00
                  0.0414150              1.0000000
            S    1   1.00
                  0.0150000              1.0000000
            P    6   1.00
                 13.6985000              0.0318210
                  6.6247600             -0.1930280
                  1.6961300              0.5062420
                  0.7973510              0.4949020
                  0.3520340              0.1440300
                  0.1233420              0.0056080
            P    6   1.00
                 13.6985000             -0.0085830
                  6.6247600              0.0568110
                  1.6961300             -0.1801720
                  0.7973510             -0.2034110
                  0.3520340              0.0848180
                  0.1233420              0.6010570
            P    6   1.00
                 13.6985000             -0.0151640
                  6.6247600              0.1011250
                  1.6961300             -0.3456410
                  0.7973510             -0.3454850
                  0.3520340              0.4221020
                  0.1233420              0.7304790
            P    1   1.00
                  0.0431300              1.0000000
            P    1   1.00
                  0.0151000              1.0000000
            D    5   1.00
                 18.7370000              0.0064810
                 11.7046000             -0.0139420
                  2.2555800              0.2506820
                  0.9494110              0.4511110
                  0.3661640              0.3839990
            D    5   1.00
                 18.7370000             -0.0075900
                 11.7046000              0.0162940
                  2.2555800             -0.3347730
                  0.9494110             -0.4463960
                  0.3661640              0.3299670
            D    1   1.00
                  0.1239770              1.0000000
            D    1   1.00
                  0.0420000              1.0000000
            F    1   1.00
                  0.9936000              1.0000000
            F    1   1.00
                  0.3222000              1.0000000
            ****
            -Pd     0
            S    7   1.00
                208.1230000              0.0007270
                 22.8525000             -0.0409280
                 14.2986000              0.1922850
                  5.4880100             -0.6501040
                  1.3253200              0.8565530
                  0.5989570              0.4438760
                  0.1209830              0.0178500
            S    7   1.00
                208.1230000             -0.0001890
                 22.8525000              0.0098180
                 14.2986000             -0.0528760
                  5.4880100              0.2035110
                  1.3253200             -0.3639350
                  0.5989570             -0.2582190
                  0.1209830              0.5704320
            S    7   1.00
                208.1230000              0.0008000
                 22.8525000             -0.0417810
                 14.2986000              0.1593620
                  5.4880100             -0.5231230
                  1.3253200              1.4917730
                  0.5989570             -0.7916960
                  0.1209830             -1.5172540
            S    1   1.00
                  0.0434590              1.0000000
            S    1   1.00
                  0.0156000              1.0000000
            P    6   1.00
                 14.0509000              0.0379970
                  7.1390600             -0.2040770
                  1.8300700              0.5137680
                  0.8583350              0.4942400
                  0.3772750              0.1402910
                  0.1256960              0.0051570
            P    6   1.00
                 14.0509000             -0.0093130
                  7.1390600              0.0546710
                  1.8300700             -0.1661610
                  0.8583350             -0.1858420
                  0.3772750              0.0731610
                  0.1256960              0.5861720
            P    6   1.00
                 14.0509000             -0.0186030
                  7.1390600              0.1098650
                  1.8300700             -0.3664000
                  0.8583350             -0.3473160
                  0.3772750              0.4820340
                  0.1256960              0.7096400
            P    1   1.00
                  0.0426590              1.0000000
            P    1   1.00
                  0.0145000              1.0000000
            D    5   1.00
                 19.2539000              0.0066240
                 10.5848000             -0.0184110
                  2.4561900              0.2633960
                  1.0352900              0.4524480
                  0.4020080              0.3758330
            D    5   1.00
                 19.2539000             -0.0078390
                 10.5848000              0.0218380
                  2.4561900             -0.3691550
                  1.0352900             -0.4309590
                  0.4020080              0.3749650
            D    1   1.00
                  0.1370570              1.0000000
            D    1   1.00
                  0.0467000              1.0000000
            F    1   1.00
                  1.1484000              1.0000000
            F    1   1.00
                  0.3788000              1.0000000
            ****
            -Ag     0
            S    8   1.00
                180.0750000              0.0008490
                 21.8987000             -0.0654500
                 13.8670000              0.2977650
                  6.1426300             -0.7531210
                  1.4381400              0.8811750
                  0.6483820              0.4351760
                  0.1288820              0.0147380
                  0.0457380             -0.0013990
            S    8   1.00
                180.0750000             -0.0002030
                 21.8987000              0.0157230
                 13.8670000             -0.0792290
                  6.1426300              0.2226340
                  1.4381400             -0.3491960
                  0.6483820             -0.2559780
                  0.1288820              0.5486660
                  0.0457380              0.6181030
            S    8   1.00
                180.0750000             -0.0008620
                 21.8987000              0.0525460
                 13.8670000             -0.2081000
                  6.1426300              0.5249720
                  1.4381400             -1.2701730
                  0.6483820              0.5393730
                  0.1288820              1.6533910
                  0.0457380             -1.5839750
            S    1   1.00
                  0.0457380              1.0000000
            S    1   1.00
                  0.0162000              1.0000000
            P    7   1.00
                 11.8751000              0.1162480
                  8.0024500             -0.3072860
                  2.0176600              0.5157360
                  0.9542300              0.5031040
                  0.4231180              0.1420950
                  0.1358850              0.0051530
                  0.0454010              0.0001040
            P    7   1.00
                 11.8751000             -0.0282840
                  8.0024500              0.0783470
                  2.0176600             -0.1567410
                  0.9542300             -0.1886250
                  0.4231180              0.0635650
                  0.1358850              0.5817780
                  0.0454010              0.4999110
            P    7   1.00
                 11.8751000             -0.0528570
                  8.0024500              0.1470390
                  2.0176600             -0.3129730
                  0.9542300             -0.3708280
                  0.4231180              0.4236290
                  0.1358850              0.7536550
                  0.0454010              0.0708700
            P    1   1.00
                  0.0454010              1.0000000
            P    1   1.00
                  0.0152000              1.0000000
            D    6   1.00
                 26.4320000              0.0034790
                 11.0345000             -0.0138480
                  2.7378700              0.2545990
                  1.1957500              0.4498490
                  0.4820420              0.3757380
                  0.1729080              0.1458790
            D    6   1.00
                 26.4320000             -0.0047330
                 11.0345000              0.0190700
                  2.7378700             -0.4332980
                  1.1957500             -0.4445680
                  0.4820420              0.4914420
                  0.1729080              0.5728660
            D    1   1.00
                  0.1729080              1.0000000
            D    1   1.00
                  0.0620000              1.0000000
            F    1   1.00
                  1.3299000              1.0000000
            F    1   1.00
                  0.4449000              1.0000000
            ****
            -Cd     0
            S    8   1.00
                223.8530000              0.0008710
                 23.0948000             -0.0643070
                 14.6522000              0.3013160
                  6.5704440             -0.7605240
                  1.5378300              0.8940710
                  0.6909840              0.4278790
                  0.1349130              0.0101880
                  0.0474420             -0.0024450
            S    8   1.00
                223.8530000             -0.0002290
                 23.0948000              0.0155940
                 14.6522000             -0.0810470
                  6.5704440              0.2272510
                  1.5378300             -0.3625630
                  0.6909840             -0.2507830
                  0.1349130              0.6135330
                  0.0474420              0.5582600
            S    8   1.00
                223.8530000              0.0010770
                 23.0948000             -0.0716490
                 14.6522000              0.2889750
                  6.5704440             -0.7315460
                  1.5378300              1.9768990
                  0.6909840             -1.3519510
                  0.1349130             -1.1186740
                  0.0474420              1.3026160
            S    1   1.00
                  0.0474420              1.0000000
            S    1   1.00
                  0.0167000              1.0000000
            P    7   1.00
                 13.7175000              0.0776160
                  8.4632200             -0.2579430
                  2.1182000              0.5352740
                  0.9892620              0.4963620
                  0.4317810              0.1231090
                  0.1391600              0.0032100
                  0.0461490              0.0003400
            P    7   1.00
                 13.7175000             -0.0180110
                  8.4632200              0.0637170
                  2.1182000             -0.1587410
                  0.9892620             -0.1762800
                  0.4317810              0.0710060
                  0.1391600              0.5775860
                  0.0461490              0.4994910
            P    7   1.00
                 13.7175000             -0.0307300
                  8.4632200              0.1087440
                  2.1182000             -0.2782310
                  0.9892620             -0.3293900
                  0.4317810              0.3546300
                  0.1391600              0.7814580
                  0.0461490              0.0852520
            P    1   1.00
                  0.0461490              1.0000000
            P    1   1.00
                  0.0153000              1.0000000
            D    6   1.00
                 31.6697000              0.0031630
                 12.2214000             -0.0117910
                  3.1219900              0.2411940
                  1.3894100              0.4489980
                  0.5732030              0.3802110
                  0.2117080              0.1445530
            D    6   1.00
                 31.6697000             -0.0048710
                 12.2214000              0.0185820
                  3.1219900             -0.4766730
                  1.3894100             -0.4576040
                  0.5732030              0.5714620
                  0.2117080              0.4973800
            D    1   1.00
                  0.2117080              1.0000000
            D    1   1.00
                  0.0782000              1.0000000
            F    1   1.00
                  1.5393000              1.0000000
            F    1   1.00
                  0.5177000              1.0000000
            ****
            -In     0
            S    8   1.00
                265.1310000              0.0007700
                 25.5694000             -0.0527910
                 16.0041000              0.2593430
                  6.8188500             -0.7392890
                  1.6667600              0.8857730
                  0.7692320              0.4425920
                  0.1704150              0.0115740
                  0.0622300             -0.0024510
            S    8   1.00
                265.1310000             -0.0002300
                 25.5694000              0.0140880
                 16.0041000             -0.0786150
                  6.8188500              0.2528640
                  1.6667600             -0.4155450
                  0.7692320             -0.2966470
                  0.1704150              0.6785780
                  0.0622300              0.5271290
            S    1   1.00
                  0.1704150              1.0000000
            S    1   1.00
                  0.0622300              1.0000000
            S    1   1.00
                  0.0203000              1.0000000
            P    6   1.00
                 14.4691000              0.0901770
                  9.2808300             -0.2676420
                  2.0820100              0.6644830
                  0.8443140              0.4616900
                  0.1869000              0.0270590
                  0.0547770             -0.0046770
            P    6   1.00
                 14.4691000             -0.0190230
                  9.2808300              0.0591570
                  2.0820100             -0.1807490
                  0.8443140             -0.1145820
                  0.1869000              0.4407390
                  0.0547770              0.6877890
            P    1   1.00
                  0.0547770              1.0000000
            P    1   1.00
                  0.0141000              1.0000000
            D    6   1.00
                 30.7879000              0.0057660
                 19.2555000             -0.0107080
                  3.1966200              0.2938600
                  1.3321000              0.5108690
                  0.5046190              0.3415190
                  0.1498000              0.0524650
            D    1   1.00
                  0.1498000              1.0000000
            D    1   1.00
                  0.0472000              1.0000000
            ****
            -Sn     0
            S    8   1.00
                380.3660000              0.0011650
                 28.5822000             -0.0260060
                 17.8892000              0.1660430
                  6.9286200             -0.6589140
                  1.7839100              0.8693360
                  0.8431380              0.4521320
                  0.2052280              0.0129730
                  0.0766360             -0.0024030
            S    8   1.00
                380.3660000             -0.0004420
                 28.5822000              0.0057020
                 17.8892000             -0.0528940
                  6.9286200              0.2520870
                  1.7839100             -0.4703430
                  0.8431380             -0.3161440
                  0.2052280              0.7206250
                  0.0766360              0.5111140
            S    1   1.00
                  0.2052280              1.0000000
            S    1   1.00
                  0.0766360              1.0000000
            S    1   1.00
                  0.0275000              1.0000000
            P    6   1.00
                 18.5489000              0.0370210
                  9.5669600             -0.1938660
                  2.2186100              0.6575940
                  0.9214590              0.4555060
                  0.2178580              0.0272160
                  0.0693200             -0.0046040
            P    6   1.00
                 18.5489000             -0.0090520
                  9.5669600              0.0517620
                  2.2186100             -0.2217430
                  0.9214590             -0.1242790
                  0.2178580              0.5218530
                  0.0693200              0.6099370
            P    1   1.00
                  0.0693200              1.0000000
            P    1   1.00
                  0.0209000              1.0000000
            D    6   1.00
                 38.5626000              0.0042610
                 21.7613000             -0.0068970
                  3.6611100              0.2762770
                  1.5583300              0.5143230
                  0.6095230              0.3445590
                  0.1897000              0.0515940
            D    1   1.00
                  0.1897000              1.0000000
            D    1   1.00
                  0.0649000              1.0000000
            ****
            -Sb     0
            S    8   1.00
                371.5840000              0.0015910
                 26.5392000             -0.0416840
                 16.6213000              0.2733430
                  7.7355100             -0.7676850
                  1.8923400              0.8994960
                  0.9104310              0.4313870
                  0.2442310              0.0128370
                  0.0923970             -0.0021730
            S    8   1.00
                371.5840000              0.0006540
                 26.5392000             -0.0109620
                 16.6213000              0.0938330
                  7.7355100             -0.3040090
                  1.8923400              0.5084090
                  0.9104310              0.3392390
                  0.2442310             -0.7347720
                  0.0923970             -0.5261340
            S    1   1.00
                  0.2442310              1.0000000
            S    1   1.00
                  0.0923970              1.0000000
            S    1   1.00
                  0.0327000              1.0000000
            P    6   1.00
                 16.0509000              0.0921570
                 10.2621000             -0.2755590
                  2.4283200              0.6586400
                  1.0336000              0.4668920
                  0.2594400              0.0285110
                  0.0861080             -0.0051550
            P    6   1.00
                 16.0509000             -0.0253130
                 10.2621000              0.0797960
                  2.4283200             -0.2420940
                  1.0336000             -0.1486050
                  0.2594400              0.5489440
                  0.0861080              0.5892910
            P    1   1.00
                  0.0861080              1.0000000
            P    1   1.00
                  0.0271000              1.0000000
            D    6   1.00
                 45.4785000              0.0032590
                 18.5114000             -0.0054970
                  3.9160000              0.2799530
                  1.7148200              0.5127510
                  0.6973190              0.3328720
                  0.2304000              0.0488430
            D    1   1.00
                  0.2304000              1.0000000
            D    1   1.00
                  0.0802000              1.0000000
            ****
            -Te     0
            S    8   1.00
               2111.1900000              0.0006120
                311.6910000              0.0032070
                 13.8226000              0.4055120
                  8.7174800             -0.9325880
                  1.9830300              0.9196570
                  0.9703770              0.4046710
                  0.2797650              0.0123660
                  0.1067760             -0.0016040
            S    8   1.00
               2111.1900000              0.0002510
                311.6910000              0.0014570
                 13.8226000              0.1637020
                  8.7174800             -0.3984550
                  1.9830300              0.5780740
                  0.9703770              0.3271240
                  0.2797650             -0.7846540
                  0.1067760             -0.4994510
            S    1   1.00
                  0.2797650              1.0000000
            S    1   1.00
                  0.1067760              1.0000000
            S    1   1.00
                  0.0369000              1.0000000
            P    6   1.00
                 17.0629000              0.0893400
                 10.8306000             -0.2711680
                  2.5938000              0.6620230
                  1.1267600              0.4607440
                  0.3001760              0.0288090
                  0.0975510             -0.0038630
            P    6   1.00
                 17.0629000             -0.0268610
                 10.8306000              0.0863040
                  2.5938000             -0.2735020
                  1.1267600             -0.1513900
                  0.3001760              0.5839760
                  0.0975510              0.5650140
            P    1   1.00
                  0.0975510              1.0000000
            P    1   1.00
                  0.0299000              1.0000000
            D    6   1.00
                 50.9106000              0.0033540
                 18.4647000             -0.0036420
                  4.2761700              0.2780800
                  1.8977000              0.5163480
                  0.7864800              0.3265710
                  0.2638000              0.0451520
            D    1   1.00
                  0.2638000              1.0000000
            D    1   1.00
                  0.0988000              1.0000000
            ****
            -I     0
            S    8   1.00
                  2.449790D+03           4.190000D-04
                  3.598080D+02           2.240000D-03
                  1.440580D+01           3.972230D-01
                  9.076320D+00          -9.322490D-01
                  2.088100D+00           9.371380D-01
                  1.034980D+00           3.920860D-01
                  3.162840D-01           1.248500D-02
                  1.217190D-01          -1.329000D-03
            S    8   1.00
                  2.449790D+03           1.750000D-04
                  3.598080D+02           1.057000D-03
                  1.440580D+01           1.690000D-01
                  9.076320D+00          -4.217930D-01
                  2.088100D+00           6.388640D-01
                  1.034980D+00           3.201150D-01
                  3.162840D-01          -8.144280D-01
                  1.217190D-01          -4.897980D-01
            S    1   1.00
                  3.162840D-01           1.000000D+00
            S    1   1.00
                  1.217190D-01           1.000000D+00
            S    1   1.00
                  4.200000D-02           1.0000000
            P    6   1.00
                  1.953010D+01           5.893400D-02
                  1.108820D+01          -2.309300D-01
                  2.715630D+00           6.648010D-01
                  1.204300D+00           4.506730D-01
                  3.399450D-01           2.898000D-02
                  1.108810D-01          -2.889000D-03
            P    6   1.00
                  1.953010D+01          -1.883600D-02
                  1.108820D+01           8.000600D-02
                  2.715630D+00          -3.066520D-01
                  1.204300D+00          -1.475940D-01
                  3.399450D-01           6.075060D-01
                  1.108810D-01           5.470490D-01
            P    1   1.00
                  1.108810D-01           1.000000D+00
            P    1   1.00
                  3.380000D-02           1.0000000
            D    6   1.00
                  4.547650D+01           4.266000D-03
                  1.319280D+01          -1.362500D-02
                  4.227410D+00           3.097560D-01
                  1.942800D+00           5.097720D-01
                  8.397710D-01           2.974610D-01
                  3.000000D-01           4.016400D-02
            D    1   1.00
                  3.000000D-01           1.000000D+00
            D    1   1.00
                  1.191000D-01           1.0000000
            ****
            -Xe     0
            S    8   1.00
               2058.3200000              0.0009380
                307.4270000              0.0044200
                 15.7815000              0.3543950
                  9.5447000             -0.8885140
                  2.2296900              0.9496240
                  1.1120000              0.3810660
                  0.3554300              0.0125430
                  0.1377260             -0.0010730
            S    8   1.00
               2058.3200000             -0.0004380
                307.4270000             -0.0022770
                 15.7815000             -0.1557960
                  9.5447000              0.4175780
                  2.2296900             -0.6793250
                  1.1120000             -0.3183090
                  0.3554300              0.8356730
                  0.1377260              0.4854110
            S    1   1.00
                  0.3554300              1.0000000
            S    1   1.00
                  0.1377260              1.0000000
            S    1   1.00
                  0.0473000              1.0000000
            P    6   1.00
                 20.1725000              0.0687400
                 11.8122000             -0.2446140
                  2.9346000              0.6676480
                  1.3189000              0.4501800
                  0.3858160              0.0286890
                  0.1269610             -0.0034820
            P    6   1.00
                 20.1725000             -0.0229670
                 11.8122000              0.0881150
                  2.9346000             -0.3233110
                  1.3189000             -0.1542280
                  0.3858160              0.6228820
                  0.1269610              0.5375650
            P    1   1.00
                  0.1269610              1.0000000
            P    1   1.00
                  0.0379000              1.0000000
            D    6   1.00
                 52.6666000              0.0048070
                 14.3464000             -0.0045170
                  4.8159700              0.3015100
                  2.2149600              0.5120370
                  0.9611280              0.2990900
                  0.3412000              0.0395700
            D    1   1.00
                  0.3412000              1.0000000
            D    1   1.00
                  0.1404000              1.0000000
            ****
            -Hf     0
            S    7   1.00
                 29.2650000              0.0294330
                 18.3491000             -0.1987340
                 11.5257000              0.4359330
                  4.3859900             -0.7730970
                  0.8910800              0.8677580
                  0.4057400              0.4202920
                  0.0950670              0.0131930
            S    7   1.00
                 29.2650000             -0.0090770
                 18.3491000              0.0611920
                 11.5257000             -0.1354740
                  4.3859900              0.2530470
                  0.8910800             -0.3699320
                  0.4057400             -0.3314430
                  0.0950670              0.6577990
            S    7   1.00
                 29.2650000              0.0309420
                 18.3491000             -0.1631770
                 11.5257000              0.3100050
                  4.3859900             -0.5289420
                  0.8910800              1.2562440
                  0.4057400             -0.4970260
                  0.0950670             -1.8102840
            S    1   1.00
                  0.0358680              1.0000000
            S    1   1.00
                  0.0135000              1.0000000
            P    6   1.00
                  7.1199600              0.1786130
                  4.6018200             -0.5085500
                  2.9004600              0.1812060
                  0.9377910              0.6364370
                  0.3915000              0.4348840
                  0.1071520              0.0442170
            P    6   1.00
                  7.1199600             -0.0485910
                  4.6018200              0.1398590
                  2.9004600             -0.0462230
                  0.9377910             -0.2282940
                  0.3915000             -0.1575630
                  0.1071520              0.5288190
            P    6   1.00
                  7.1199600             -0.0658780
                  4.6018200              0.1871460
                  2.9004600             -0.0488380
                  0.9377910             -0.3615180
                  0.3915000             -0.1743340
                  0.1071520              0.9190410
            P    1   1.00
                  0.0367710              1.0000000
            P    1   1.00
                  0.0126000              1.0000000
            D    5   1.00
                  7.4982700              0.0144910
                  4.6961800             -0.0529680
                  1.0636000              0.2380440
                  0.4188210              0.4352750
                  0.1545660              0.4244200
            D    5   1.00
                  7.4982700             -0.0165460
                  4.6961800              0.0618730
                  1.0636000             -0.3167410
                  0.4188210             -0.5274120
                  0.1545660              0.3428660
            D    1   1.00
                  0.0526440              1.0000000
            D    1   1.00
                  0.0179000              1.0000000
            F    1   1.00
                  0.2700000              1.0000000
            F    1   1.00
                  0.0824000              1.0000000
            ****
            -Ta     0
            S    7   1.00
                 29.8670000              0.0287250
                 18.7203000             -0.1985810
                 11.7533000              0.4482880
                  4.5708900             -0.7983960
                  0.9478400              0.8861040
                  0.4340380              0.4136940
                  0.1050310              0.0121460
            S    7   1.00
                 29.8670000             -0.0091320
                 18.7203000              0.0630170
                 11.7533000             -0.1437480
                  4.5708900              0.2705360
                  0.9478400             -0.4015970
                  0.4340380             -0.3195670
                  0.1050310              0.6651050
            S    7   1.00
                 29.8670000              0.0324720
                 18.7203000             -0.1723550
                 11.7533000              0.3341840
                  4.5708900             -0.5725580
                  0.9478400              1.3652610
                  0.4340380             -0.6032250
                  0.1050310             -1.7315730
            S    1   1.00
                  0.0389480              1.0000000
            S    1   1.00
                  0.0144000              1.0000000
            P    6   1.00
                  7.3652400              0.1796820
                  4.7544000             -0.5211000
                  2.9959500              0.1911040
                  0.9941230              0.6464550
                  0.4196000              0.4240400
                  0.1182390              0.0425600
            P    6   1.00
                  7.3652400             -0.0508780
                  4.7544000              0.1495500
                  2.9959500             -0.0507540
                  0.9941230             -0.2483790
                  0.4196000             -0.1478010
                  0.1182390              0.5415390
            P    6   1.00
                  7.3652400             -0.0697670
                  4.7544000              0.2016550
                  2.9959500             -0.0482900
                  0.9941230             -0.4247200
                  0.4196000             -0.1275720
                  0.1182390              0.9415430
            P    1   1.00
                  0.0401010              1.0000000
            P    1   1.00
                  0.0136000              1.0000000
            D    5   1.00
                  7.5616000              0.0178690
                  4.7408700             -0.0661360
                  1.1697500              0.2554580
                  0.4793100              0.4454920
                  0.1837040              0.4029670
            D    5   1.00
                  7.5616000             -0.0205840
                  4.7408700              0.0780240
                  1.1697500             -0.3544000
                  0.4793100             -0.5155940
                  0.1837040              0.4207610
            D    1   1.00
                  0.0644090              1.0000000
            D    1   1.00
                  0.0226000              1.0000000
            F    1   1.00
                  0.3735000              1.0000000
            F    1   1.00
                  0.1286000              1.0000000
            ****
            -W     0
            S    7   1.00
                 31.1844000              0.0268990
                 19.5385000             -0.1892380
                 12.2602000              0.4339650
                  4.7203700             -0.8043720
                  1.0095700              0.9015400
                  0.4634560              0.4101950
                  0.1137920              0.0110440
            S    7   1.00
                 31.1844000             -0.0086330
                 19.5385000              0.0609770
                 12.2602000             -0.1418640
                  4.7203700              0.2797320
                  1.0095700             -0.4285050
                  0.4634560             -0.3050150
                  0.1137920              0.6713040
            S    7   1.00
                 31.1844000              0.0314780
                 19.5385000             -0.1676990
                 12.2602000              0.3282920
                  4.7203700             -0.5865250
                  1.0095700              1.4154490
                  0.4634560             -0.6488270
                  0.1137920             -1.6892530
            S    1   1.00
                  0.0416420              1.0000000
            S    1   1.00
                  0.0152000              1.0000000
            P    6   1.00
                  7.7873800              0.1852090
                  5.0493000             -0.5283120
                  3.1860200              0.1871580
                  1.0593700              0.6560130
                  0.4491060              0.4179250
                  0.1276250              0.0409650
            P    6   1.00
                  7.7873800             -0.0535080
                  5.0493000              0.1546790
                  3.1860200             -0.0504270
                  1.0593700             -0.2604500
                  0.4491060             -0.1384050
                  0.1276250              0.5459010
            P    6   1.00
                  7.7873800             -0.0749390
                  5.0493000              0.2120220
                  3.1860200             -0.0424460
                  1.0593700             -0.4793750
                  0.4491060             -0.0766750
                  0.1276250              0.9477960
            P    1   1.00
                  0.0427440              1.0000000
            P    1   1.00
                  0.0143000              1.0000000
            D    5   1.00
                  8.3098300              0.0219490
                  5.2246300             -0.0773760
                  1.2952900              0.2632410
                  0.5397610              0.4595460
                  0.2089270              0.3922120
            D    5   1.00
                  8.3098300             -0.0263810
                  5.2246300              0.0952520
                  1.2952900             -0.3960520
                  0.5397610             -0.5079960
                  0.2089270              0.5236000
            D    1   1.00
                  0.0731130              1.0000000
            D    1   1.00
                  0.0256000              1.0000000
            F    1   1.00
                  0.4769000              1.0000000
            F    1   1.00
                  0.1768000              1.0000000
            ****
            -Re     0
            S    7   1.00
                 33.0133000              0.0221330
                 20.6658000             -0.1618310
                 12.9498000              0.3812300
                  4.7782300             -0.7875220
                  1.0858000              0.8980810
                  0.5000250              0.4224690
                  0.1210690              0.0172060
            S    7   1.00
                 33.0133000             -0.0070680
                 20.6658000              0.0530520
                 12.9498000             -0.1282310
                  4.7782300              0.2853960
                  1.0858000             -0.4487810
                  0.5000250             -0.2976680
                  0.1210690              0.6634730
            S    7   1.00
                 33.0133000              0.0274240
                 20.6658000             -0.1468310
                 12.9498000              0.2908580
                  4.7782300             -0.5801000
                  1.0858000              1.4204980
                  0.5000250             -0.6321790
                  0.1210690             -1.6875030
            S    1   1.00
                  0.0438810              1.0000000
            S    1   1.00
                  0.0159000              1.0000000
            P    6   1.00
                  8.6759800              0.1394900
                  5.6538200             -0.3569770
                  1.4063900              0.4818040
                  0.6920560              0.5117960
                  0.3163520              0.1708180
                  0.1093090              0.0097820
            P    6   1.00
                  8.6759800             -0.0412390
                  5.6538200              0.1083450
                  1.4063900             -0.1688840
                  0.6920560             -0.2386860
                  0.3163520              0.0632430
                  0.1093090              0.6102210
            P    6   1.00
                  8.6759800             -0.0651350
                  5.6538200              0.1725300
                  1.4063900             -0.2649320
                  0.6920560             -0.4743410
                  0.3163520              0.3991830
                  0.1093090              0.8030920
            P    1   1.00
                  0.0385810              1.0000000
            P    1   1.00
                  0.0136000              1.0000000
            D    5   1.00
                  8.6719700              0.0171910
                  5.4414200             -0.0665390
                  1.3750800              0.2711570
                  0.5838300              0.4487710
                  0.2293620              0.3778590
            D    5   1.00
                  8.6719700             -0.0203340
                  5.4414200              0.0775390
                  1.3750800             -0.3686920
                  0.5838300             -0.4745880
                  0.2293620              0.4599950
            D    1   1.00
                  0.0808850              1.0000000
            D    1   1.00
                  0.0285000              1.0000000
            F    1   1.00
                  0.5533000              1.0000000
            F    1   1.00
                  0.2126000              1.0000000
            ****
            -Os     0
            S    7   1.00
                 34.5933000              0.0194050
                 21.6442000             -0.1468750
                 13.5521000              0.3551890
                  4.8950800             -0.7883690
                  1.1634600              0.9033000
                  0.5380840              0.4302560
                  0.1306730              0.0181640
            S    7   1.00
                 34.5933000             -0.0059240
                 21.6442000              0.0475810
                 13.5521000             -0.1198590
                  4.8950800              0.2905900
                  1.1634600             -0.4633260
                  0.5380840             -0.2910580
                  0.1306730              0.6489970
            S    7   1.00
                 34.5933000              0.0286790
                 21.6442000             -0.1533520
                 13.5521000              0.3066570
                  4.8950800             -0.6590400
                  1.1634600              1.6880660
                  0.5380840             -0.9098660
                  0.1306730             -1.5178370
            S    1   1.00
                  0.0469820              1.0000000
            S    1   1.00
                  0.0169000              1.0000000
            P    6   1.00
                  9.1259400              0.1316100
                  5.8907300             -0.3487910
                  1.4397800              0.5276330
                  0.6929760              0.5000040
                  0.3084380              0.1387070
                  0.1086800              0.0055910
            P    6   1.00
                  9.1259400             -0.0379630
                  5.8907300              0.1036120
                  1.4397800             -0.1857190
                  0.6929760             -0.2213770
                  0.3084380              0.0960590
                  0.1086800              0.6029380
            P    6   1.00
                  9.1259400             -0.0676070
                  5.8907300              0.1858450
                  1.4397800             -0.3480470
                  0.6929760             -0.4511480
                  0.3084380              0.5586130
                  0.1086800              0.7068530
            P    1   1.00
                  0.0381830              1.0000000
            P    1   1.00
                  0.0134000              1.0000000
            D    5   1.00
                  9.3395000              0.0158420
                  5.8557100             -0.0635100
                  1.4647600              0.2828700
                  0.6312200              0.4507810
                  0.2506620              0.3664550
            D    5   1.00
                  9.3395000             -0.0209240
                  5.8557100              0.0807150
                  1.4647600             -0.4242800
                  0.6312200             -0.4620180
                  0.2506620              0.5555660
            D    1   1.00
                  0.0891640              1.0000000
            D    1   1.00
                  0.0317000              1.0000000
            F    1   1.00
                  0.6278000              1.0000000
            F    1   1.00
                  0.2478000              1.0000000
            ****
            -Ir     0
            S    7   1.00
                 36.0577000              0.0172890
                 22.5516000             -0.1359910
                 14.1116000              0.3386690
                  5.0447500             -0.7941690
                  1.2441700              0.9080010
                  0.5769240              0.4378070
                  0.1394660              0.0187690
            S    7   1.00
                 36.0577000             -0.0049480
                 22.5516000              0.0431240
                 14.1116000             -0.1138030
                  5.0447500              0.2953180
                  1.2441700             -0.4732180
                  0.5769240             -0.2840000
                  0.1394660              0.6351880
            S    7   1.00
                 36.0577000              0.0290550
                 22.5516000             -0.1546790
                 14.1116000              0.3116730
                  5.0447500             -0.7039290
                  1.2441700              1.8161160
                  0.5769240             -1.0291110
                  0.1394660             -1.4393180
            S    1   1.00
                  0.0497400              1.0000000
            S    1   1.00
                  0.0177000              1.0000000
            P    6   1.00
                  9.5858000              0.1256510
                  6.1408800             -0.3433060
                  1.4976000              0.5536780
                  0.7141440              0.4910420
                  0.3120660              0.1228370
                  0.1151600              0.0033780
            P    6   1.00
                  9.5858000             -0.0379390
                  6.1408800              0.1069870
                  1.4976000             -0.2083670
                  0.7141440             -0.2217720
                  0.3120660              0.1266520
                  0.1151600              0.6103680
            P    6   1.00
                  9.5858000             -0.0740030
                  6.1408800              0.2101790
                  1.4976000             -0.4612670
                  0.7141440             -0.3768670
                  0.3120660              0.6521120
                  0.1151600              0.6073860
            P    1   1.00
                  0.0412770              1.0000000
            P    1   1.00
                  0.0148000              1.0000000
            D    5   1.00
                  9.9606900              0.0154630
                  6.2430300             -0.0631200
                  1.5631700              0.2923090
                  0.6819400              0.4527480
                  0.2734460              0.3571590
            D    5   1.00
                  9.9606900             -0.0198010
                  6.2430300              0.0777020
                  1.5631700             -0.4252400
                  0.6819400             -0.4331870
                  0.2734460              0.4752470
            D    1   1.00
                  0.0980080              1.0000000
            D    1   1.00
                  0.0351000              1.0000000
            F    1   1.00
                  0.7127000              1.0000000
            F    1   1.00
                  0.2898000              1.0000000
            ****
            -Pt     0
            S    7   1.00
                 37.3750000              0.0156980
                 23.3685000             -0.1285150
                 14.6164000              0.3299960
                  5.2209620             -0.8039770
                  1.3267320              0.9127650
                  0.6163210              0.4444260
                  0.1480680              0.0192250
            S    7   1.00
                 37.3750000             -0.0041400
                 23.3685000              0.0396870
                 14.6164000             -0.1100630
                  5.2209620              0.3003960
                  1.3267320             -0.4809750
                  0.6163210             -0.2769970
                  0.1480680              0.6216130
            S    7   1.00
                 37.3750000              0.0303040
                 23.3685000             -0.1595530
                 14.6164000              0.3222870
                  5.2209620             -0.7469090
                  1.3267320              1.9183060
                  0.6163210             -1.1164460
                  0.1480680             -1.3836520
            S    1   1.00
                  0.0523910              1.0000000
            S    1   1.00
                  0.0185000              1.0000000
            P    6   1.00
                  9.9926800              0.1240460
                  6.3831700             -0.3446320
                  1.5696500              0.5711200
                  0.7427790              0.4873560
                  0.3180200              0.1119590
                  0.1141460              0.0019280
            P    6   1.00
                  9.9926800             -0.0346870
                  6.3831700              0.0999320
                  1.5696500             -0.2018840
                  0.7427790             -0.1984590
                  0.3180200              0.1230340
                  0.1141460              0.5955770
            P    6   1.00
                  9.9926800             -0.0771530
                  6.3831700              0.2234940
                  1.5696500             -0.5228040
                  0.7427790             -0.3298980
                  0.3180200              0.7297730
                  0.1141460              0.5372880
            P    1   1.00
                  0.0398630              1.0000000
            P    1   1.00
                  0.0139000              1.0000000
            D    5   1.00
                 10.4126000              0.0150800
                  6.5226600             -0.0622950
                  1.6643000              0.3006490
                  0.7342080              0.4539610
                  0.2974070              0.3490010
            D    5   1.00
                 10.4126000             -0.0198660
                  6.5226600              0.0796630
                  1.6643000             -0.4687940
                  0.7342080             -0.4051740
                  0.2974070              0.5192890
            D    1   1.00
                  0.1075990              1.0000000
            D    1   1.00
                  0.0389000              1.0000000
            F    1   1.00
                  0.8018000              1.0000000
            F    1   1.00
                  0.3357000              1.0000000
            ****
            -Au     0
            S    8   1.00
                 38.0008000              0.0200090
                 23.9725000             -0.1516790
                 15.2182000              0.3639600
                  5.5399900             -0.8213260
                  1.3855100              0.9366410
                  0.6424610              0.4235270
                  0.1564960              0.0162500
                  0.0549100             -0.0009780
            S    8   1.00
                 38.0008000             -0.0053040
                 23.9725000              0.0463180
                 15.2182000             -0.1199400
                  5.5399900              0.3040620
                  1.3855100             -0.4945010
                  0.6424610             -0.2555160
                  0.1564960              0.6091630
                  0.0549100              0.5977670
            S    8   1.00
                 38.0008000              0.0323400
                 23.9725000             -0.1717620
                 15.2182000              0.3395030
                  5.5399900             -0.7461790
                  1.3855100              1.9174980
                  0.6424610             -1.1299310
                  0.1564960             -1.3662840
                  0.0549100              1.4423910
            S    1   1.00
                  0.0549100              1.0000000
            S    1   1.00
                  0.0193000              1.0000000
            P    7   1.00
                 10.3092000              0.1282170
                  6.6276500             -0.3537900
                  1.6744700              0.5662110
                  0.8011160              0.4931710
                  0.3468790              0.1137750
                  0.1227010              0.0025340
                  0.0424280              0.0006790
            P    7   1.00
                 10.3092000             -0.0358850
                  6.6276500              0.1028900
                  1.6744700             -0.2009880
                  0.8011160             -0.2010450
                  0.3468790              0.1165490
                  0.1227010              0.5949690
                  0.0424280              0.4555200
            P    7   1.00
                 10.3092000             -0.0772420
                  6.6276500              0.2226110
                  1.6744700             -0.4953530
                  0.8011160             -0.3607470
                  0.3468790              0.7100000
                  0.1227010              0.5688390
                  0.0424280              0.0011930
            P    1   1.00
                  0.0424280              1.0000000
            P    1   1.00
                  0.0147000              1.0000000
            D    6   1.00
                 11.0027000              0.0164670
                  6.8916600             -0.0680130
                  1.8080800              0.2994920
                  0.8210510              0.4543030
                  0.3441610              0.3442240
                  0.1297430              0.1212560
            D    6   1.00
                 11.0027000             -0.0236280
                  6.8916600              0.0956720
                  1.8080800             -0.5412940
                  0.8210510             -0.3955330
                  0.3441610              0.6191650
                  0.1297430              0.4682760
            D    1   1.00
                  0.1297430              1.0000000
            D    1   1.00
                  0.0489000              1.0000000
            F    1   1.00
                  0.8919000              1.0000000
            F    1   1.00
                  0.3789000              1.0000000
            ****
            -Hg     0
            S    8   1.00
                 41.4804000              0.0100720
                 22.5328000             -0.1147810
                 14.0790000              0.3564080
                  5.7247400             -0.8484430
                  1.4794800              0.9405960
                  0.6882660              0.4353290
                  0.1641810              0.0131780
                  0.0572230             -0.0023140
            S    8   1.00
                 41.4804000              0.0020320
                 22.5328000             -0.0323140
                 14.0790000              0.1153500
                  5.7247400             -0.3177630
                  1.4794800              0.5135230
                  0.6882660              0.2500500
                  0.1641810             -0.6488410
                  0.0572230             -0.5599430
            S    8   1.00
                 41.4804000              0.0218280
                 22.5328000             -0.1555640
                 14.0790000              0.3860250
                  5.7247400             -0.8961040
                  1.4794800              2.3321950
                  0.6882660             -1.5976600
                  0.1641810             -1.0536460
                  0.0572230              1.2895360
            S    1   1.00
                  0.0572230              1.0000000
            S    1   1.00
                  0.0199000              1.0000000
            P    7   1.00
                 10.5805000              0.1286920
                  6.8053900             -0.3608420
                  1.7901600              0.5641170
                  0.8622610              0.5002740
                  0.3752770              0.1137850
                  0.1284210              0.0029390
                  0.0434470              0.0004880
            P    7   1.00
                 10.5805000             -0.0344430
                  6.8053900              0.1009290
                  1.7901600             -0.1924390
                  0.8622610             -0.1960690
                  0.3752770              0.1042040
                  0.1284210              0.5873870
                  0.0434470              0.4727830
            P    7   1.00
                 10.5805000              0.0714680
                  6.8053900             -0.2108590
                  1.7901600              0.4452040
                  0.8622610              0.3916080
                  0.3752770             -0.6670830
                  0.1284210             -0.6195740
                  0.0434470             -0.0009090
            P    1   1.00
                  0.0434470              1.0000000
            P    1   1.00
                  0.0147000              1.0000000
            D    6   1.00
                 11.5841000              0.0167290
                  7.2487900             -0.0695580
                  1.9366200              0.3034370
                  0.8987480              0.4548780
                  0.3869310              0.3368080
                  0.1504660              0.1130160
            D    6   1.00
                 11.5841000             -0.0249840
                  7.2487900              0.1041030
                  1.9366200             -0.6169860
                  0.8987480             -0.3538260
                  0.3869310              0.6872800
                  0.1504660              0.3930900
            D    1   1.00
                  0.1504660              1.0000000
            D    1   1.00
                  0.0585000              1.0000000
            F    1   1.00
                  0.9974000              1.0000000
            F    1   1.00
                  0.4377000              1.0000000
            ****
            -Tl     0
            S    8   1.00
                 36.1096000              0.0229790
                 22.5732000             -0.1728970
                 14.1144000              0.4807030
                  6.1597600             -0.9532140
                  1.5706900              0.9608670
                  0.7459610              0.4319720
                  0.1958840              0.0131990
                  0.0710030             -0.0021060
            S    8   1.00
                 36.1096000              0.0059010
                 22.5732000             -0.0544410
                 14.1144000              0.1709120
                  6.1597600             -0.3868060
                  1.5706900              0.5717530
                  0.7459610              0.2895580
                  0.1958840             -0.7163850
                  0.0710030             -0.5289600
            S    1   1.00
                  0.1958840              1.0000000
            S    1   1.00
                  0.0710030              1.0000000
            S    1   1.00
                  0.0206000              1.0000000
            P    6   1.00
                 10.3856000              0.1621170
                  7.0093900             -0.4046950
                  1.7768800              0.6949780
                  0.7479420              0.4664960
                  0.1768080              0.0280130
                  0.0515320             -0.0041730
            P    6   1.00
                 10.3856000             -0.0391990
                  7.0093900              0.1017260
                  1.7768800             -0.2199420
                  0.7479420             -0.1194500
                  0.1768080              0.4597680
                  0.0515320              0.6763890
            P    1   1.00
                  0.0515320              1.0000000
            P    1   1.00
                  0.0130000              1.0000000
            D    6   1.00
                 10.9087000              0.0217120
                  6.8364900             -0.0832690
                  1.9974900              0.3418070
                  0.9144720              0.4833160
                  0.3895180              0.3047550
                  0.1501000              0.0649830
            D    1   1.00
                  0.1501000              1.0000000
            D    1   1.00
                  0.0437000              1.0000000
            ****
            -Pb     0
            S    8   1.00
                 37.4583000              0.0248240
                 23.3170000             -0.1810620
                 14.5759000              0.5007060
                  6.4337600             -0.9797370
                  1.6671900              0.9666300
                  0.8077320              0.4364870
                  0.2270840              0.0136860
                  0.0842520             -0.0020210
            S    8   1.00
                 37.4583000              0.0067850
                 23.3170000             -0.0601870
                 14.5759000              0.1889710
                  6.4337600             -0.4248380
                  1.6671900              0.6220350
                  0.8077320              0.3160880
                  0.2270840             -0.7594740
                  0.0842520             -0.5151310
            S    1   1.00
                  0.2270840              1.0000000
            S    1   1.00
                  0.0842520              1.0000000
            S    1   1.00
                  0.0278000              1.0000000
            P    6   1.00
                 10.6186000              0.1701740
                  7.1878100             -0.4241790
                  1.8943900              0.6934430
                  0.8167090              0.4737730
                  0.2036880              0.0290470
                  0.0649730             -0.0043860
            P    6   1.00
                 10.6186000             -0.0479540
                  7.1878100              0.1245560
                  1.8943900             -0.2597760
                  0.8167090             -0.1414800
                  0.2036880              0.5317690
                  0.0649730              0.6087590
            P    1   1.00
                  0.0649730              1.0000000
            P    1   1.00
                  0.0197000              1.0000000
            D    6   1.00
                 13.7266000              0.0107870
                  6.9898300             -0.0666500
                  2.1735200              0.3342590
                  1.0281200              0.4826840
                  0.4558570              0.3004140
                  0.1822000              0.0632580
            D    1   1.00
                  0.1822000              1.0000000
            D    1   1.00
                  0.0609000              1.0000000
            ****
            -Bi     0
            S    8   1.00
                211.8210000              0.0010880
                 21.3262000             -0.1058620
                 13.3654000              0.5308080
                  6.9461000             -1.0502650
                  1.7122900              0.9958560
                  0.8391070              0.3989520
                  0.2553640              0.0117780
                  0.0967000             -0.0014700
            S    8   1.00
                211.8210000              0.0004220
                 21.3262000             -0.0385370
                 13.3654000              0.2172380
                  6.9461000             -0.4810970
                  1.7122900              0.7015950
                  0.8391070              0.2905200
                  0.2553640             -0.7997780
                  0.0967000             -0.4961310
            S    1   1.00
                  0.2553640              1.0000000
            S    1   1.00
                  0.0967000              1.0000000
            S    1   1.00
                  0.0317000              1.0000000
            P    6   1.00
                 11.0644000              0.1672490
                  7.4500000             -0.4252620
                  2.0106900              0.6925250
                  0.8883210              0.4753740
                  0.2363690              0.0298590
                  0.0792900             -0.0044930
            P    6   1.00
                 11.0644000             -0.0522010
                  7.4500000              0.1390830
                  2.0106900             -0.2935560
                  0.8883210             -0.1585740
                  0.2363690              0.5743620
                  0.0792900              0.5726780
            P    1   1.00
                  0.0792900              1.0000000
            P    1   1.00
                  0.0254000              1.0000000
            D    6   1.00
                 16.2461000              0.0078080
                  6.9836300             -0.0668310
                  2.3747600              0.3241400
                  1.1537200              0.4858310
                  0.5259740              0.3010560
                  0.2151000              0.0631960
            D    1   1.00
                  0.2151000              1.0000000
            D    1   1.00
                  0.0745000              1.0000000
            ****
            -Po     0
            S    8   1.00
                295.3900000              0.0013830
                 21.2683000             -0.1050610
                 13.3379000              0.5914250
                  7.3652100             -1.1156970
                  1.7892000              1.0191620
                  0.8849940              0.3798790
                  0.2857870              0.0107810
                  0.1093240             -0.0011440
            S    8   1.00
                295.3900000              0.0006830
                 21.2683000             -0.0385730
                 13.3379000              0.2519580
                  7.3652100             -0.5330160
                  1.7892000              0.7669010
                  0.8849940              0.2818780
                  0.2857870             -0.8394770
                  0.1093240             -0.4792720
            S    1   1.00
                  0.2857870              1.0000000
            S    1   1.00
                  0.1093240              1.0000000
            S    1   1.00
                  0.0359000              1.0000000
            P    6   1.00
                 11.5069000              0.1663640
                  7.7299100             -0.4272350
                  2.1189400              0.6969640
                  0.9553230              0.4713590
                  0.2683520              0.0299870
                  0.0884940             -0.0034870
            P    6   1.00
                 11.5069000             -0.0559100
                  7.7299100              0.1511230
                  2.1189400             -0.3261600
                  0.9553230             -0.1614090
                  0.2683520              0.6016150
                  0.0884940              0.5559720
            P    1   1.00
                  0.0884940              1.0000000
            P    1   1.00
                  0.0278000              1.0000000
            D    6   1.00
                 18.7130000              0.0066940
                  7.0570800             -0.0671040
                  2.5506200              0.3257980
                  1.2506900              0.4957630
                  0.5742560              0.2931060
                  0.2330000              0.0541620
            D    1   1.00
                  0.2330000              1.0000000
            D    1   1.00
                  0.0895000              1.0000000
            ****
            -At     0
            S    8   1.00
                304.0310000              0.0010310
                 22.4085000             -0.1018690
                 14.0490000              0.5632730
                  7.5895000             -1.1045120
                  1.8949400              1.0263640
                  0.9523580              0.3833240
                  0.3170410              0.0113590
                  0.1224900             -0.0011400
            S    8   1.00
                304.0310000              0.0004960
                 22.4085000             -0.0387430
                 14.0490000              0.2490070
                  7.5895000             -0.5516910
                  1.8949400              0.8155580
                  0.9523580              0.2868020
                  0.3170410             -0.8682780
                  0.1224900             -0.4694960
            S    1   1.00
                  0.3170410              1.0000000
            S    1   1.00
                  0.1224900              1.0000000
            S    1   1.00
                  0.0404000              1.0000000
            P    6   1.00
                 12.0093000              0.1631810
                  8.0330000             -0.4244130
                  2.2239300              0.7031340
                  1.0213300              0.4641680
                  0.3012660              0.0302600
                  0.0999030             -0.0026180
            P    6   1.00
                 12.0093000             -0.0583630
                  8.0330000              0.1606310
                  2.2239300             -0.3589420
                  1.0213300             -0.1621230
                  0.3012660              0.6248880
                  0.0999030              0.5397840
            P    1   1.00
                  0.0999030              1.0000000
            P    1   1.00
                  0.0313000              1.0000000
            D    6   1.00
                 21.3084000              0.0061410
                  7.0207600             -0.0706690
                  2.7689800              0.3190200
                  1.3731400              0.5044700
                  0.6368040              0.2924810
                  0.2593000              0.0514950
            D    1   1.00
                  0.2593000              1.0000000
            D    1   1.00
                  0.1073000              1.0000000
            ****
            -Rn     0
            S    8   1.00
                383.5850000              0.0015720
                 23.2936000             -0.0761810
                 14.6096000              0.4785080
                  7.7319900             -1.0439020
                  1.9942400              1.0190710
                  1.0240700              0.3914520
                  0.3454220              0.0127820
                  0.1350810             -0.0012970
            S    8   1.00
                383.5850000              0.0009020
                 23.2936000             -0.0265350
                 14.6096000              0.2148510
                  7.7319900             -0.5453780
                  1.9942400              0.8694020
                  1.0240700              0.2728620
                  0.3454220             -0.8929670
                  0.1350810             -0.4539150
            S    1   1.00
                  0.3454220              1.0000000
            S    1   1.00
                  0.1350810              1.0000000
            S    1   1.00
                  0.0449000              1.0000000
            P    6   1.00
                 12.4992000              0.1629940
                  8.3397600             -0.4262290
                  2.3359100              0.7107760
                  1.0901900              0.4580860
                  0.3348980              0.0292130
                  0.1125460             -0.0031070
            P    6   1.00
                 12.4992000             -0.0609340
                  8.3397600              0.1694830
                  2.3359100             -0.3880550
                  1.0901900             -0.1612760
                  0.3348980              0.6446740
                  0.1125460              0.5255260
            P    1   1.00
                  0.1125460              1.0000000
            P    1   1.00
                  0.0348000              1.0000000
            D    6   1.00
                 24.1705000              0.0058780
                  6.9459900             -0.0765200
                  3.0380900              0.3071660
                  1.5168400              0.5141680
                  0.7091570              0.2972850
                  0.2888000              0.0512000
            D    1   1.00
                  0.2888000              1.0000000
            D    1   1.00
                  0.1251000              1.0000000
            ****
            
            -Y     0
            Y-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2      7.85827500           135.13497400
            2      3.38212800            15.41163200
            p-g potential
              4
            2      6.84979100            29.25143700
            2      6.71009200            58.50836300
            2      3.04215900             3.78024300
            2      2.93733000             7.67654700
            d-g potential
              4
            2      5.41631500            11.84991100
            2      5.33341600            17.77810300
            2      1.97621200             2.06238300
            2      1.96111100             3.07565000
            f-g potential
              2
            2      5.02859000            -6.92807800
            2      5.00558200            -9.15509900
            -ZR     0
            ZR-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2      8.63652800           150.24299400
            2      3.71763900            18.78003600
            p-g potential
              4
            2      7.62672800            33.19279100
            2      7.45320700            66.38903900
            2      3.35838900             4.62072600
            2      3.22973800             9.26027000
            d-g potential
              4
            2      5.93808600            13.99338300
            2      5.82554400            20.99588200
            2      2.20501900             2.28516600
            2      2.20629200             3.44126000
            f-g potential
              2
            2      4.80021500            -5.23932000
            2      4.79899200            -6.98742400
            -NB     0
            NB-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2      9.37657800           165.15673600
            2      4.04357200            21.82395100
            p-g potential
              4
            2      8.36360900            37.24928400
            2      8.16689800            74.50738900
            2      3.69307500             5.43948600
            2      3.55104700            10.91325200
            d-g potential
              4
            2      6.68910800            15.21454900
            2      6.53719300            22.83350800
            2      2.55111800             3.00005200
            2      2.56789600             4.55373400
            f-g potential
              2
            2      5.56828500            -6.28135400
            2      5.67137200            -8.75564400
            -MO     0
            MO-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     10.09700000           180.07685300
            2      4.37567000            24.71592000
            p-g potential
              4
            2      9.12656400            41.22767800
            2      8.86322300            82.45267000
            2      4.04494800             6.34509200
            2      3.86665700            12.45842300
            d-g potential
              4
            2      7.53575400            19.30874400
            2      7.27897600            28.97767400
            2      2.76320500             3.18951600
            2      2.77208500             4.70016900
            f-g potential
              2
            2      6.30663300            -7.17888800
            2      6.35644800            -9.74597800
            -TC     0
            TC-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     10.79936900           195.09130300
            2      4.70725700            27.34041300
            p-g potential
              4
            2      9.82669900            45.06081200
            2      9.56111500            90.11729500
            2      4.37857800             7.07051700
            2      4.19090700            14.04801900
            d-g potential
              4
            2      8.33604500            21.65775500
            2      8.24453300            32.47195900
            2      3.09370700             3.78952500
            2      3.16872200             6.05343000
            f-g potential
              2
            2      7.04094000            -7.99562300
            2      7.06947300           -10.74569600
            -RU     0
            RU-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     11.50059000           209.78649300
            2      5.06857500            30.21430700
            p-g potential
              4
            2     10.53263400            48.75124400
            2     10.19201000            97.49652900
            2      4.73489200             7.86018800
            2      4.50906500            15.32975100
            d-g potential
              4
            2      8.87797700            26.96750600
            2      8.76612200            40.43230300
            2      3.17019600             3.34075800
            2      3.22885100             5.25635200
            f-g potential
              2
            2      7.82024900            -8.84752500
            2      7.83964700           -11.83551800
            -RH     0
            RH-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     12.19481600           225.31205400
            2      5.40513700            32.44158200
            p-g potential
              4
            2     11.28075500            52.87282600
            2     10.92724800           105.74552600
            2      5.09011700             8.61934400
            2      4.85183200            16.97345900
            d-g potential
              4
            2      9.13633700            25.10850100
            2      8.96480800            37.69573100
            2      3.64361200             4.20258400
            2      3.63600700             6.29279000
            f-g potential
              2
            2      8.61622800            -9.67356800
            2      8.62943500           -12.89984700
            -PD     0
            PD-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     12.79882500           240.26278900
            2      5.80052800            34.72996100
            p-g potential
              4
            2     11.87469700            56.74692900
            2     11.47433500           113.44441700
            2      5.51599900             9.34563900
            2      5.24804300            18.34544700
            d-g potential
              4
            2      8.50221200            28.59555400
            2      7.98332400            43.45392100
            2      3.10762800             1.85228600
            2      2.47673400             1.40676500
            f-g potential
              2
            2      9.67957100           -10.98725500
            2      9.69134900           -14.62619000
            -AG     0
            AG-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     12.5677140            255.0547710
            2      6.9976620             36.9833930
            p-g potential
              4
            2     11.3164960             60.7157050
            2     10.9580630            121.4438890
            2      7.1114000             10.1718660
            2      6.7733190             20.4865640
            d-g potential
              4
            2      8.9284370             29.5049380
            2     11.1025670             44.0187360
            2      5.5432120              5.3683330
            2      3.9288350              7.4083750
            f-g potential
              2
            2     11.0129130            -12.6234030
            2     11.0198980            -16.7643270
            -CD     0
            CD-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     13.3551760            270.0394480
            2      7.3083780             38.8777660
            p-g potential
              4
            2     12.6597280             64.6074700
            2     12.2896390            129.2194450
            2      6.7861760             10.6225580
            2      6.4007430             21.2650460
            d-g potential
              4
            2     11.1617220             31.6639650
            2     11.2196150             47.4892160
            2      4.5377330              5.1862000
            2      4.3357270              7.5660630
            f-g potential
              2
            2     11.4789860            -12.6327850
            2     11.4870270            -16.7601710
            -IN     0
            IN-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     15.3928220            281.1223500
            2      8.0558640             61.9014700
            p-g potential
              4
            2     13.9286720             67.4621540
            2     13.3472340            134.9492500
            2      7.6141320             14.7461400
            2      7.3183650             29.6392620
            d-g potential
              4
            2     14.0347150             35.4932540
            2     14.5116160             53.1787730
            2      5.5505500              9.1772810
            2      5.0594150             12.3924100
            f-g potential
              2
            2     12.5390560            -13.7280780
            2     12.5525610            -18.2068660
            -SN     0
            SN-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     17.4204140            279.9886820
            2      7.6311550             62.3778100
            p-g potential
              4
            2     16.1310240             66.1625230
            2     15.6280770            132.1743960
            2      7.3256080             16.3394170
            2      6.9425190             32.4889590
            d-g potential
              4
            2     15.5149760             36.3874410
            2     15.1881600             54.5078410
            2      5.4560240              8.6968230
            2      5.3631050             12.8402080
            f-g potential
              2
            2     12.2823480            -12.5763330
            2     12.2721500            -16.5959440
            -SB     0
            SB-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     16.3308650            281.0715810
            2      8.5565420             61.7166040
            p-g potential
              4
            2     14.4703370             67.4573800
            2     13.8161940            134.9335030
            2      8.4249240             14.7163440
            2      8.0927280             29.5185120
            d-g potential
              4
            2     14.8863310             35.4478150
            2     15.1463190             53.1434660
            2      5.9082670              9.1792230
            2      5.5943220             13.2402530
            f-g potential
              2
            2     14.4449780            -15.3668010
            2     14.4492950            -20.2961380
            -TE     0
            TE-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     16.8144730            281.0458430
            2      8.7935260             61.6206560
            p-g potential
              4
            2     14.8778010             67.4494640
            2     14.2697310            134.9043040
            2      8.7244350             14.6895470
            2      8.2915150             29.4150630
            d-g potential
              4
            2     15.2050080             35.4320570
            2     15.2258480             53.1356870
            2      6.0717690              9.0698020
            2      5.8047600             13.1223040
            f-g potential
              2
            2     15.2061680            -15.7454500
            2     15.2017020            -20.7424480
            -I     0
            I-ECP     4     28
            g potential
              1
            2      1.00000000             0.00000000
            s-g potential
              3
            2     40.03337600            49.98964900
            2     17.30057600           281.00655600
            2      8.85172000            61.41673900
            p-g potential
              4
            2     15.72014100            67.41623900
            2     15.20822200           134.80769600
            2      8.29418600            14.56654800
            2      7.75394900            28.96842200
            d-g potential
              4
            2     13.81775100            35.53875600
            2     13.58780500            53.33975900
            2      6.94763000             9.71646600
            2      6.96009900            14.97750000
            f-g potential
              4
            2     18.52295000           -20.17661800
            2     18.25103500           -26.08807700
            2      7.55790100            -0.22043400
            2      7.59740400            -0.22164600
            -XE     0
            XE-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              3
            2     40.0051840             49.9979620
            2     17.8122140            281.0133030
            2      9.3041500             61.5382550
            p-g potential
              4
            2     15.7017720             67.4391420
            2     15.2586080            134.8747110
            2      9.2921840             14.6633000
            2      8.5590030             29.3547300
            d-g potential
              6
            2     15.1856000             35.4369080
            2     14.2845000             53.1957720
            2      7.1218890              9.0462320
            2      6.9919630             13.2236810
            2      0.6239460              0.0848530
            2      0.6472840              0.0441550
            f-g potential
              4
            2     20.8815570            -23.0892950
            2     20.7834430            -30.0744750
            2      5.2533890             -0.2882270
            2      5.3611880             -0.3869240
            -HF     0
            HF-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              3
            2     10.24885600           478.23740400
            4     10.72912700             0.38802400
            2      1.96485600            -1.07123200
            p-h potential
              6
            2      8.68346200           101.04681800
            2      7.91692000           212.19776100
            4      9.37924300             0.13264600
            4      8.24420900             0.45310800
            2      1.59668600            -0.40791400
            2      1.71028100            -0.56181700
            d-h potential
              6
            2      5.18955700            43.11546700
            2      5.25322900            65.93473200
            4      5.93787100             0.02591200
            4      5.71290600             0.03374100
            2      1.01485600            -0.28057900
            2      0.47371200            -0.08484900
            f-h potential
              2
            2      1.91260800             4.81180100
            2      1.88074000             6.41857400
            g-h potential
              2
            2      2.72418000            -4.63658500
            2      2.70895300            -5.76728800
            -TA     0
            TA-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              3
            2     10.31806900           454.60064900
            4     10.54026700             2.83797500
            2      2.57472600            -0.81473600
            p-h potential
              6
            2      8.74334200            96.91078300
            2      7.91622300           195.85043200
            4      9.27573600             4.81252400
            4      8.10167500             6.33851200
            2      2.07712700            -0.45917300
            2      2.75037200            -0.64458600
            d-h potential
              6
            2      5.44731400            45.96997600
            2      5.21254500            69.63897200
            4      5.88435800             0.80293300
            4      5.64957900             0.42959500
            2      1.38818000            -0.30722700
            2      1.29439800            -0.46156000
            f-h potential
              2
            2      2.16127500             5.75777300
            2      2.12593900             7.67816700
            g-h potential
              2
            2      3.14592000            -5.68406600
            2      3.12794200            -7.06231300
            -W     0
            W-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     11.06379500           419.22759900
            2      8.21764100            41.19130700
            p-h potential
              6
            2      9.33818800           107.34811000
            2      8.43044800           214.69956800
            4      9.49002000             0.02544200
            4      9.48994700             0.05189500
            2      1.88299700            -0.11718400
            2      1.90697200             0.29668900
            d-h potential
              6
            2      6.20543300            58.88127900
            2      6.12215700            98.68355600
            4      6.27455600             0.01953700
            4      6.22637500             0.02195600
            2      1.96387500            -0.08857700
            2      1.88828700            -0.20972600
            f-h potential
              2
            2      2.30795300             6.23247200
            2      2.27060900             8.31134500
            g-h potential
              2
            2      3.58349100            -6.80294400
            2      3.56251500            -8.44323200
            -RE     0
            RE-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     12.16381400           421.97030000
            2      7.10759500            50.13443900
            p-h potential
              4
            2      9.68459700            88.48191000
            2      9.47621400           176.78722000
            2      7.66806600            10.43433800
            2      5.05515600            20.45874300
            d-h potential
              4
            2      6.50988800            43.16243100
            2      6.09121600            64.76775900
            2      4.16400600             5.34030100
            2      4.40737900             8.24333200
            f-h potential
              2
            2      2.56265800             7.24454300
            2      2.52154900             9.65926600
            g-h potential
              2
            2      4.03459900            -7.97494000
            2      4.00962800            -9.88273600
            -OS     0
            OS-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     13.00200100           424.39037600
            2      6.96276300            57.12250300
            p-h potential
              4
            2     10.49894100            88.27900300
            2      9.99252300           176.48606400
            2      6.58824800            11.71501200
            2      5.03716700            22.91500600
            d-h potential
              4
            2      7.08344100            44.77770800
            2      6.72117900            67.15364800
            2      3.79462600             5.55038700
            2      3.74812500             8.22010400
            f-h potential
              2
            2      2.82627600             8.32833200
            2      2.78119800            11.10310200
            g-h potential
              2
            2      4.49698100            -9.18134300
            2      4.46773800           -11.36160400
            -IR     0
            IR-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     13.83147400           426.95814900
            2      7.04791400            65.33881300
            p-h potential
              4
            2     11.10643300            88.07544200
            2     10.45655200           176.12477000
            2      6.37961400            12.68226000
            2      5.06472600            24.63594900
            d-h potential
              4
            2      7.54875400            46.43325800
            2      7.26530800            69.63807400
            2      3.80096900             6.15024800
            2      3.71828000             9.46356000
            f-h potential
              2
            2      3.09870600             9.48361000
            2      3.04946100            12.64274200
            g-h potential
              2
            2      4.96979000           -10.41069700
            2      4.93561400           -12.86319600
            -PT     0
            PT-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     14.60450000           429.64608700
            2      7.21828700            73.15688400
            p-h potential
              4
            2     11.57716200            88.02291700
            2     10.88384300           175.99819600
            2      6.42440300            13.68227400
            2      5.22419800            27.41465100
            d-h potential
              4
            2      7.69961000            43.55785200
            2      7.55080800            65.36910800
            2      3.96116400             7.01859600
            2      3.87277700            11.39173300
            f-h potential
              2
            2      3.37986900            10.71022000
            2      3.32625500            14.27812500
            g-h potential
              2
            2      5.45202000           -11.65174900
            2      5.41258500           -14.37552500
            -AU     0
            AU-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     13.5232180            426.6418670
            2      6.2643840             36.8006680
            p-h potential
              4
            2     11.4138670             87.0020910
            2     10.3292150            174.0043700
            2      5.7074240              8.8706100
            2      4.8281650             17.9024380
            d-h potential
              4
            2      7.4309630             49.8836550
            2      8.3219900             74.6845490
            2      4.6096420              6.4862270
            2      3.5115070              9.5468210
            f-h potential
              2
            2      3.0846390              8.7916400
            2      3.0247430             11.6584560
            g-h potential
              2
            2      3.9784420             -5.2343370
            2      4.0114910             -6.7381420
            -HG     0
            HG-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     12.4130710            275.7747970
            2      6.8979130             49.2678980
            p-h potential
              4
            2     11.3103200             80.5069840
            2     10.2107730            161.0348240
            2      5.9398040              9.0834160
            2      5.0197550             18.3677730
            d-h potential
              4
            2      8.4078950             51.1372560
            2      8.2140860             76.7074590
            2      4.0126120              6.5618210
            2      3.7953980              9.8180700
            f-h potential
              2
            2      3.2731060              9.4290010
            2      3.2083210             12.4948560
            g-h potential
              2
            2      4.4852960             -6.3384140
            2      4.5132000             -8.0998630
            -TL     0
            TL-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     12.1678050            281.2846630
            2      8.2949090             62.4342510
            p-h potential
              4
            2      7.1514920              4.6334080
            2      5.1728650              9.3417560
            2      9.8910720             72.2992530
            2      9.0033910            144.5580370
            d-h potential
              4
            2      7.1302180             35.9430390
            2      6.9269060             53.9095930
            2      5.4175700             10.3819390
            2      5.1386810             15.5838220
            f-h potential
              4
            2      5.6263990             15.8254880
            2      5.5489520             21.1040210
            2      2.8749460              2.9151270
            2      2.8214510              3.8969030
            g-h potential
              4
            2      6.6790570             -7.4945340
            2      6.7068350             -9.5405750
            2      7.2092840             -7.7979920
            2      7.0709640             -9.2595240
            -PB     0
            PB-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     12.2963030            281.2854990
            2      8.6326340             62.5202170
            p-h potential
              4
            2     10.2417900             72.2768970
            2      8.9241760            144.5910830
            2      6.5813420              4.7586930
            2      6.2554030              9.9406210
            d-h potential
              4
            2      7.7543360             35.8485070
            2      7.7202810             53.7243420
            2      4.9702640             10.1152560
            2      4.5637890             14.8337310
            f-h potential
              2
            2      3.8875120             12.2098920
            2      3.8119630             16.1902910
            g-h potential
              2
            2      5.6915770             -9.0966650
            2      5.7155670            -11.5319960
            -BI     0
            BI-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     13.0430900            283.2642270
            2      8.2216820             62.4719590
            p-h potential
              4
            2     10.4677770             72.0014990
            2      9.1189010            144.0022770
            2      6.7547910              5.0079450
            2      6.2525920              9.9915500
            d-h potential
              4
            2      8.0814740             36.3962590
            2      7.8905950             54.5976640
            2      4.9555560              9.9842940
            2      4.7045590             14.9814850
            f-h potential
              2
            2      4.2145460             13.7133830
            2      4.1334000             18.1943080
            g-h potential
              2
            2      6.2057090            -10.2474430
            2      6.2277820            -12.9557100
            -PO     0
            PO-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     13.2772270            283.2447060
            2      8.3995180             62.3964610
            p-h potential
              4
            2     10.6656820             71.9917160
            2      9.2837530            143.9718710
            2      6.8727490              4.9496150
            2      6.3261500              9.7404990
            d-h potential
              4
            2      8.2148660             36.3783830
            2      8.0086960             54.5627150
            2      5.0552270              9.8894990
            2      4.7825530             14.6938770
            f-h potential
              4
            2      5.0132700             17.4282950
            2      4.9846400             23.3803530
            2      1.3267600              0.1633920
            2      1.5287580              0.3245660
            g-h potential
              2
            2      6.7715260            -11.5632940
            2      6.7779250            -14.5097880
            -AT     0
            AT-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              3
            2     30.2008320             49.9571580
            2     13.6123060            283.2103710
            2      8.5293400             62.2810520
            p-h potential
              4
            2     10.8540650             71.9823710
            2      9.4682290            143.9035320
            2      7.0311140              4.8717590
            2      6.1438580              8.9830590
            d-h potential
              4
            2      8.3135150             36.3632370
            2      7.9989650             54.5489700
            2      5.1799660              9.7762850
            2      4.9422260             14.2647550
            f-h potential
              4
            2      5.8121630             19.8701980
            2      5.7537150             26.4164520
            2      2.5134720              0.9949700
            2      2.5362610              1.4907010
            g-h potential
              4
            2      9.8957780            -22.2232030
            2      9.7373340            -26.7154760
            2      3.0133310             -0.3730440
            2      3.0977630             -0.4859460
            -RN     0
            RN-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              3
            2     30.1512420             49.9655510
            2     14.5212410            283.0700000
            2      8.0520380             62.0028700
            p-h potential
              4
            2     11.0099420             71.9691190
            2      9.6176250            143.8605590
            2      7.3360080              4.7147610
            2      6.4062530              9.0130650
            d-h potential
              4
            2      8.3692200             36.3683650
            2      8.1169750             54.5517610
            2      5.3536560              9.6344870
            2      5.0972120             14.3879020
            f-h potential
              4
            2      6.3485710             21.7972900
            2      6.2959490             28.9468050
            2      2.8821180              1.4473650
            2      2.9080480              2.1779640
            g-h potential
              4
            2     11.0152050            -25.2280950
            2     10.9098530            -30.5661210
            2      3.4827610             -0.5748000
            2      3.6004180             -0.7795380
            
 Initial command:
 /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1.exe "/projects/academic/jochena/pierpa/VROA36_Benchmark/VROA_532/Experimental_Lasers/B3LYPDBJ_augccpVDZ/27_methylindane_Boat_STD/Gau-45889.inp" -scrdir="/projects/academic/jochena/pierpa/VROA36_Benchmark/VROA_532/Experimental_Lasers/B3LYPDBJ_augccpVDZ/27_methylindane_Boat_STD/"
 Entering Link 1 = /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1.exe PID=     45890.
  
 Copyright (c) 1988,1990,1992,1993,1995,1998,2003,2009,2016,
            Gaussian, Inc.  All Rights Reserved.
  
 This is part of the Gaussian(R) 16 program.  It is based on
 the Gaussian(R) 09 system (copyright 2009, Gaussian, Inc.),
 the Gaussian(R) 03 system (copyright 2003, Gaussian, Inc.),
 the Gaussian(R) 98 system (copyright 1998, Gaussian, Inc.),
 the Gaussian(R) 94 system (copyright 1995, Gaussian, Inc.),
 the Gaussian 92(TM) system (copyright 1992, Gaussian, Inc.),
 the Gaussian 90(TM) system (copyright 1990, Gaussian, Inc.),
 the Gaussian 88(TM) system (copyright 1988, Gaussian, Inc.),
 the Gaussian 86(TM) system (copyright 1986, Carnegie Mellon
 University), and the Gaussian 82(TM) system (copyright 1983,
 Carnegie Mellon University). Gaussian is a federally registered
 trademark of Gaussian, Inc.
  
 This software contains proprietary and confidential information,
 including trade secrets, belonging to Gaussian, Inc.
  
 This software is provided under written license and may be
 used, copied, transmitted, or stored only in accord with that
 written license.
  
 The following legend is applicable only to US Government
 contracts under FAR:
  
                    RESTRICTED RIGHTS LEGEND
  
 Use, reproduction and disclosure by the US Government is
 subject to restrictions as set forth in subparagraphs (a)
 and (c) of the Commercial Computer Software - Restricted
 Rights clause in FAR 52.227-19.
  
 Gaussian, Inc.
 340 Quinnipiac St., Bldg. 40, Wallingford CT 06492
  
  
 ---------------------------------------------------------------
 Warning -- This program may not be used in any manner that
 competes with the business of Gaussian, Inc. or will provide
 assistance to any competitor of Gaussian, Inc.  The licensee
 of this program is prohibited from giving any competitor of
 Gaussian, Inc. access to this program.  By using this program,
 the user acknowledges that Gaussian, Inc. is engaged in the
 business of creating and licensing software in the field of
 computational chemistry and represents and warrants to the
 licensee that it is not a competitor of Gaussian, Inc. and that
 it will not use this program in any manner prohibited above.
 ---------------------------------------------------------------
  

 Cite this work as:
 Gaussian 16, Revision A.03,
 M. J. Frisch, G. W. Trucks, H. B. Schlegel, G. E. Scuseria, 
 M. A. Robb, J. R. Cheeseman, G. Scalmani, V. Barone, 
 G. A. Petersson, H. Nakatsuji, X. Li, M. Caricato, A. V. Marenich, 
 J. Bloino, B. G. Janesko, R. Gomperts, B. Mennucci, H. P. Hratchian, 
 J. V. Ortiz, A. F. Izmaylov, J. L. Sonnenberg, D. Williams-Young, 
 F. Ding, F. Lipparini, F. Egidi, J. Goings, B. Peng, A. Petrone, 
 T. Henderson, D. Ranasinghe, V. G. Zakrzewski, J. Gao, N. Rega, 
 G. Zheng, W. Liang, M. Hada, M. Ehara, K. Toyota, R. Fukuda, 
 J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, 
 T. Vreven, K. Throssell, J. A. Montgomery, Jr., J. E. Peralta, 
 F. Ogliaro, M. J. Bearpark, J. J. Heyd, E. N. Brothers, K. N. Kudin, 
 V. N. Staroverov, T. A. Keith, R. Kobayashi, J. Normand, 
 K. Raghavachari, A. P. Rendell, J. C. Burant, S. S. Iyengar, 
 J. Tomasi, M. Cossi, J. M. Millam, M. Klene, C. Adamo, R. Cammi, 
 J. W. Ochterski, R. L. Martin, K. Morokuma, O. Farkas, 
 J. B. Foresman, and D. J. Fox, Gaussian, Inc., Wallingford CT, 2016.
 
 ******************************************
 Gaussian 16:  ES64L-G16RevA.03 25-Dec-2016
                 8-Jul-2021 
 ******************************************
 %NoSave
 %nproc=16
 Will use up to   16 processors via shared memory.
 %mem=80GB
 %chk=27_methylindane_Boat_STD_B3LYPDBJ-augccpVDZr
 ----------------------------------------------------------------------
 #P B3LYP/Gen EmpiricalDispersion=GD3BJ Integral=UltraFineGrid SCF=(NoS
 ymm,MaxCyc=120) Polar=ROA Guess=Read Geom=Check CPHF=RdFreq
 ----------------------------------------------------------------------
 1/29=2,38=1,83=21,172=1/1;
 2/12=2,40=1/2;
 3/5=7,11=2,14=-4,25=1,30=1,36=2,74=-5,75=-5,116=-2,124=41/1,2,3;
 4/5=1,9=2/1;
 5/5=2,7=120,38=6,98=1/2;
 8/6=4,10=90,11=11/1;
 10/13=10,49=112,72=3/2;
 6/7=2,8=2,9=2,10=2,28=1/1;
 7/8=1,25=21/16;
 99/5=1/99;
 Leave Link    1 at Thu Jul  8 18:26:04 2021, MaxMem= 10737418240 cpu:               2.4 elap:               0.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l101.exe)
 -----------------
 ROA calculations.
 -----------------
 Structure from the checkpoint file:  "27_methylindane_Boat_STD_B3LYPDBJ-augccpVDZr.chk"
 Charge =  0 Multiplicity = 1
 No Z-Matrix found in chk file; cartesian coordinates used.
  C                                                -2.164986000000     -1.224920000000     -0.005005000000
  C                                                -2.642020000000      0.073409000000      0.146690000000
  C                                                -1.762079000000      1.153232000000      0.130794000000
  C                                                -0.405452000000      0.917524000000     -0.034454000000
  C                                                 0.074285000000     -0.384887000000     -0.186400000000
  C                                                -0.802207000000     -1.459935000000     -0.173869000000
  C                                                 1.577720000000     -0.384146000000     -0.367381000000
  C                                                 1.970002000000      1.020984000000      0.144037000000
  C                                                 0.731931000000      1.906712000000     -0.098518000000
  H                                                -2.856720000000     -2.057467000000      0.013689000000
  H                                                -3.702276000000      0.244250000000      0.283207000000
  H                                                -2.135971000000      2.162786000000      0.253773000000
  H                                                -0.437393000000     -2.473544000000     -0.286670000000
  H                                                 1.789870000000     -0.436688000000     -1.443748000000
  C                                                 2.317593000000     -1.524644000000      0.320775000000
  H                                                 2.873170000000      1.403772000000     -0.331853000000
  H                                                 2.163642000000      0.958387000000      1.218672000000
  H                                                 0.772481000000      2.369953000000     -1.090624000000
  H                                                 0.637692000000      2.716269000000      0.626868000000
  H                                                 2.108272000000     -1.526468000000      1.392826000000
  H                                                 3.396620000000     -1.425796000000      0.184958000000
  H                                                 2.021897000000     -2.495429000000     -0.081110000000
 Recover connectivity data from disk.
 ITRead=  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0
 ITRead=  0  0
 MicOpt= -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1
 MicOpt= -1 -1
 NAtoms=     22 NQM=       22 NQMF=       0 NMMI=      0 NMMIF=      0
                NMic=       0 NMicF=      0.
                    Isotopes and Nuclear Properties:
 (Nuclear quadrupole moments (NQMom) in fm**2, nuclear magnetic moments (NMagM)
  in nuclear magnetons)

  Atom         1           2           3           4           5           6           7           8           9          10
 IAtWgt=          12          12          12          12          12          12          12          12          12           1
 AtmWgt=  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000   1.0078250
 NucSpn=           0           0           0           0           0           0           0           0           0           1
 AtZEff=   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   1.0000000
 NQMom=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
 NMagM=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   2.7928460
 AtZNuc=   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   1.0000000

  Atom        11          12          13          14          15          16          17          18          19          20
 IAtWgt=           1           1           1           1          12           1           1           1           1           1
 AtmWgt=   1.0078250   1.0078250   1.0078250   1.0078250  12.0000000   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250
 NucSpn=           1           1           1           1           0           1           1           1           1           1
 AtZEff=   1.0000000   1.0000000   1.0000000   1.0000000   3.6000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000
 NQMom=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
 NMagM=    2.7928460   2.7928460   2.7928460   2.7928460   0.0000000   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460
 AtZNuc=   1.0000000   1.0000000   1.0000000   1.0000000   6.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000

  Atom        21          22
 IAtWgt=           1           1
 AtmWgt=   1.0078250   1.0078250
 NucSpn=           1           1
 AtZEff=   1.0000000   1.0000000
 NQMom=    0.0000000   0.0000000
 NMagM=    2.7928460   2.7928460
 AtZNuc=   1.0000000   1.0000000
 Using perturbation frequencies:    0.085645
 Leave Link  101 at Thu Jul  8 18:26:05 2021, MaxMem= 10737418240 cpu:               2.9 elap:               0.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l202.exe)
                          Input orientation:                          
 ---------------------------------------------------------------------
 Center     Atomic      Atomic             Coordinates (Angstroms)
 Number     Number       Type             X           Y           Z
 ---------------------------------------------------------------------
      1          6           0       -2.164986   -1.224920   -0.005005
      2          6           0       -2.642020    0.073409    0.146690
      3          6           0       -1.762079    1.153232    0.130794
      4          6           0       -0.405452    0.917524   -0.034454
      5          6           0        0.074285   -0.384887   -0.186400
      6          6           0       -0.802207   -1.459935   -0.173869
      7          6           0        1.577720   -0.384146   -0.367381
      8          6           0        1.970002    1.020984    0.144037
      9          6           0        0.731931    1.906712   -0.098518
     10          1           0       -2.856720   -2.057467    0.013689
     11          1           0       -3.702276    0.244250    0.283207
     12          1           0       -2.135971    2.162786    0.253773
     13          1           0       -0.437393   -2.473544   -0.286670
     14          1           0        1.789870   -0.436688   -1.443748
     15          6           0        2.317593   -1.524644    0.320775
     16          1           0        2.873170    1.403772   -0.331853
     17          1           0        2.163642    0.958387    1.218672
     18          1           0        0.772481    2.369953   -1.090624
     19          1           0        0.637692    2.716269    0.626868
     20          1           0        2.108272   -1.526468    1.392826
     21          1           0        3.396620   -1.425796    0.184958
     22          1           0        2.021897   -2.495429   -0.081110
 ---------------------------------------------------------------------
                    Distance matrix (angstroms):
                    1          2          3          4          5
     1  C    0.000000
     2  C    1.391485   0.000000
     3  C    2.415861   1.393042   0.000000
     4  C    2.772525   2.397411   1.386832   0.000000
     5  C    2.398519   2.774761   2.416331   1.396248   0.000000
     6  C    1.393167   2.416364   2.800503   2.414366   1.387128
     7  C    3.853059   4.275492   3.710252   2.395445   1.514289
     8  C    4.707911   4.708360   3.734447   2.384396   2.383150
     9  C    4.267082   3.847684   2.615416   1.508720   2.385717
    10  H    1.082580   2.145791   3.394192   3.855075   3.380584
    11  H    2.145877   1.082574   2.147986   3.379831   3.857299
    12  H    3.397699   2.152452   1.083567   2.151383   3.401415
    13  H    2.150110   3.396344   3.883629   3.400585   2.152756
    14  H    4.281609   4.736174   4.198020   2.939292   2.127637
    15  C    4.504385   5.213621   4.883732   3.674962   2.566847
    16  H    5.692088   5.693522   4.665013   3.327799   3.324788
    17  H    5.000124   5.002671   4.078324   2.858713   2.853774
    18  H    4.767640   4.296961   3.065333   2.147690   2.982322
    19  H    4.877216   4.239315   2.906557   2.181967   3.255150
    20  H    4.506173   5.165049   4.873719   3.785371   2.816783
    21  H    5.568474   6.222078   5.767711   4.471582   3.501329
    22  H    4.376068   5.329441   5.260808   4.188371   2.873789
                    6          7          8          9         10
     6  C    0.000000
     7  C    2.618935   0.000000
     8  C    3.733787   1.545906   0.000000
     9  C    3.700482   2.456761   1.541482   0.000000
    10  H    2.147847   4.754942   5.726351   5.348432   0.000000
    11  H    3.394638   5.356912   5.726903   4.750967   2.466882
    12  H    3.884059   4.545789   4.263188   2.900783   4.288083
    13  H    1.083151   2.903925   4.265300   4.537550   2.473152
    14  H    3.062432   1.098332   2.162942   2.901793   5.132431
    15  C    3.159432   1.523715   2.575321   3.803201   5.210731
    16  H    4.661992   2.208190   1.090280   2.211854   6.703075
    17  H    4.072310   2.158996   1.093735   2.164280   5.979247
    18  H    4.241241   2.959147   2.185901   1.095678   5.830322
    19  H    4.489451   3.388917   2.209563   1.091077   5.947727
    20  H    3.306032   2.164420   2.840441   3.988126   5.180263
    21  H    4.214270   2.167605   2.832604   4.276276   6.287496
    22  H    3.009388   2.176410   3.523996   4.587282   4.899153
                   11         12         13         14         15
    11  H    0.000000
    12  H    2.476885   0.000000
    13  H    4.286097   4.967172   0.000000
    14  H    5.797389   5.005104   3.232385   0.000000
    15  C    6.274490   5.782375   2.976466   2.139084   0.000000
    16  H    6.705168   5.100054   5.098573   2.407726   3.051264
    17  H    5.982815   4.568181   4.561753   3.028931   2.644875
    18  H    5.140961   3.210828   5.056639   3.006162   4.421233
    19  H    5.006426   2.852849   5.378152   3.944123   4.571772
    20  H    6.174882   5.737738   3.193442   3.055348   1.092297
    21  H    7.293355   6.594863   4.002482   2.492522   1.092024
    22  H    6.356471   6.252918   2.467963   2.479724   1.091500
                   16         17         18         19         20
    16  H    0.000000
    17  H    1.762364   0.000000
    18  H    2.433543   3.043139   0.000000
    19  H    2.763902   2.401854   1.757237   0.000000
    20  H    3.485096   2.491566   4.809777   4.555229   0.000000
    21  H    2.923619   2.876305   4.787580   4.996366   1.768875
    22  H    3.998913   3.693016   5.123680   5.438663   1.766022
                   21         22
    21  H    0.000000
    22  H    1.762036   0.000000
 Stoichiometry    C10H12
 Framework group  C1[X(C10H12)]
 Deg. of freedom    60
 Full point group                 C1      NOp   1
 RotChk:  IX=0 Diff= 5.53D-17
 Largest Abelian subgroup         C1      NOp   1
 Largest concise Abelian subgroup C1      NOp   1
                         Standard orientation:                         
 ---------------------------------------------------------------------
 Center     Atomic      Atomic             Coordinates (Angstroms)
 Number     Number       Type             X           Y           Z
 ---------------------------------------------------------------------
      1          6           0       -2.164986   -1.224920   -0.005005
      2          6           0       -2.642020    0.073409    0.146690
      3          6           0       -1.762079    1.153232    0.130794
      4          6           0       -0.405452    0.917524   -0.034454
      5          6           0        0.074285   -0.384887   -0.186400
      6          6           0       -0.802207   -1.459935   -0.173869
      7          6           0        1.577720   -0.384146   -0.367381
      8          6           0        1.970002    1.020984    0.144037
      9          6           0        0.731931    1.906712   -0.098518
     10          1           0       -2.856720   -2.057467    0.013689
     11          1           0       -3.702276    0.244250    0.283207
     12          1           0       -2.135971    2.162786    0.253773
     13          1           0       -0.437393   -2.473544   -0.286670
     14          1           0        1.789870   -0.436688   -1.443748
     15          6           0        2.317593   -1.524644    0.320775
     16          1           0        2.873170    1.403772   -0.331853
     17          1           0        2.163642    0.958387    1.218672
     18          1           0        0.772481    2.369953   -1.090624
     19          1           0        0.637692    2.716269    0.626868
     20          1           0        2.108272   -1.526468    1.392826
     21          1           0        3.396620   -1.425796    0.184958
     22          1           0        2.021897   -2.495429   -0.081110
 ---------------------------------------------------------------------
 Rotational constants (GHZ):           2.3914598           1.2314279           0.8455004
 Leave Link  202 at Thu Jul  8 18:26:05 2021, MaxMem= 10737418240 cpu:               0.3 elap:               0.1
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l301.exe)
 General basis read from cards:  (5D, 7F)
 Centers:      10     11     12     13     14     16     17     18     19     20
 Centers:      21     22
 S 4 1.00
     Exponent=  1.3010000000D+01 Coefficients=  1.9685000000D-02
     Exponent=  1.9620000000D+00 Coefficients=  1.3797700000D-01
     Exponent=  4.4460000000D-01 Coefficients=  4.7814800000D-01
     Exponent=  1.2200000000D-01 Coefficients=  5.0124000000D-01
 S 1 1.00
     Exponent=  1.2200000000D-01 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  2.9740000000D-02 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  7.2700000000D-01 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  1.4100000000D-01 Coefficients=  1.0000000000D+00
 ****
 Centers:       1      2      3      4      5      6      7      8      9     15
 S 9 1.00
     Exponent=  6.6650000000D+03 Coefficients=  6.9200000000D-04
     Exponent=  1.0000000000D+03 Coefficients=  5.3290000000D-03
     Exponent=  2.2800000000D+02 Coefficients=  2.7077000000D-02
     Exponent=  6.4710000000D+01 Coefficients=  1.0171800000D-01
     Exponent=  2.1060000000D+01 Coefficients=  2.7474000000D-01
     Exponent=  7.4950000000D+00 Coefficients=  4.4856400000D-01
     Exponent=  2.7970000000D+00 Coefficients=  2.8507400000D-01
     Exponent=  5.2150000000D-01 Coefficients=  1.5204000000D-02
     Exponent=  1.5960000000D-01 Coefficients= -3.1910000000D-03
 S 9 1.00
     Exponent=  6.6650000000D+03 Coefficients= -1.4600000000D-04
     Exponent=  1.0000000000D+03 Coefficients= -1.1540000000D-03
     Exponent=  2.2800000000D+02 Coefficients= -5.7250000000D-03
     Exponent=  6.4710000000D+01 Coefficients= -2.3312000000D-02
     Exponent=  2.1060000000D+01 Coefficients= -6.3955000000D-02
     Exponent=  7.4950000000D+00 Coefficients= -1.4998100000D-01
     Exponent=  2.7970000000D+00 Coefficients= -1.2726200000D-01
     Exponent=  5.2150000000D-01 Coefficients=  5.4452900000D-01
     Exponent=  1.5960000000D-01 Coefficients=  5.8049600000D-01
 S 1 1.00
     Exponent=  1.5960000000D-01 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  4.6900000000D-02 Coefficients=  1.0000000000D+00
 P 4 1.00
     Exponent=  9.4390000000D+00 Coefficients=  3.8109000000D-02
     Exponent=  2.0020000000D+00 Coefficients=  2.0948000000D-01
     Exponent=  5.4560000000D-01 Coefficients=  5.0855700000D-01
     Exponent=  1.5170000000D-01 Coefficients=  4.6884200000D-01
 P 1 1.00
     Exponent=  1.5170000000D-01 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  4.0410000000D-02 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  5.5000000000D-01 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  1.5100000000D-01 Coefficients=  1.0000000000D+00
 ****
 Ernie: Thresh=  0.10000D-02 Tol=  0.10000D-05 Strict=F.
 Ernie:  30 primitive shells out of 376 were deleted.
 There are   358 symmetry adapted cartesian basis functions of A   symmetry.
 There are   338 symmetry adapted basis functions of A   symmetry.
   338 basis functions,   614 primitive gaussians,   358 cartesian basis functions
    36 alpha electrons       36 beta electrons
       nuclear repulsion energy       504.1844683919 Hartrees.
 IExCor=  402 DFT=T Ex+Corr=B3LYP ExCW=0 ScaHFX=  0.200000
 ScaDFX=  0.800000  0.720000  1.000000  0.810000 ScalE2=  1.000000  1.000000
 IRadAn=      5 IRanWt=     -1 IRanGd=            0 ICorTp=0 IEmpDi=141
 NAtoms=   22 NActive=   22 NUniq=   22 SFac= 1.00D+00 NAtFMM=   60 NAOKFM=F Big=F
 Integral buffers will be    131072 words long.
 Raffenetti 2 integral format.
 Two-electron integral symmetry is turned on.
 R6Disp:  Grimme-D3(BJ) Dispersion energy=       -0.0407868148 Hartrees.
 Nuclear repulsion after empirical dispersion term =      504.1436815771 Hartrees.
 Leave Link  301 at Thu Jul  8 18:26:08 2021, MaxMem= 10737418240 cpu:              34.0 elap:               2.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l302.exe)
 NPDir=0 NMtPBC=     1 NCelOv=     1 NCel=       1 NClECP=     1 NCelD=      1
         NCelK=      1 NCelE2=     1 NClLst=     1 CellRange=     0.0.
 One-electron integrals computed using PRISM.
 One-electron integral symmetry used in STVInt
 NBasis=   338 RedAO= T EigKep=  1.42D-06  NBF=   338
 NBsUse=   338 1.00D-06 EigRej= -1.00D+00 NBFU=   338
 Precomputing XC quadrature grid using
 IXCGrd= 4 IRadAn=           5 IRanWt=          -1 IRanGd=           0 AccXCQ= 0.00D+00.
 Generated NRdTot=       0 NPtTot=           0 NUsed=           0 NTot=          32
 NSgBfM=   358   358   358   358   358 MxSgAt=    22 MxSgA2=    22.
 Leave Link  302 at Thu Jul  8 18:26:09 2021, MaxMem= 10737418240 cpu:               9.7 elap:               0.7
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l303.exe)
 DipDrv:  MaxL=2.
 Leave Link  303 at Thu Jul  8 18:26:09 2021, MaxMem= 10737418240 cpu:               1.5 elap:               0.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l401.exe)
 Initial guess from the checkpoint file:  "27_methylindane_Boat_STD_B3LYPDBJ-augccpVDZr.chk"
 SCF N**3 symmetry information disabled.
 B after Tr=     0.000000   -0.000000    0.000000
         Rot=    1.000000   -0.000000    0.000000   -0.000000 Ang=   0.00 deg.
 Guess basis will be translated and rotated to current coordinates.
 JPrj=2 DoOrth=T DoCkMO=T.
 Leave Link  401 at Thu Jul  8 18:26:10 2021, MaxMem= 10737418240 cpu:               8.4 elap:               0.6
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l502.exe)
 Integral symmetry usage will be decided dynamically.
 Closed shell SCF:
 Using DIIS extrapolation, IDIIS=  1040.
 NGot= 10737418240 LenX= 10737152694 LenY= 10737024089
 Requested convergence on RMS density matrix=1.00D-08 within 120 cycles.
 Requested convergence on MAX density matrix=1.00D-06.
 Requested convergence on             energy=1.00D-06.
 No special actions if energy rises.
 Fock matrices will be formed incrementally for  20 cycles.

 Cycle   1  Pass 1  IDiag  1:
 FoFJK:  IHMeth= 1 ICntrl=       0 DoSepK=F KAlg= 0 I1Cent=           0 FoldK=F
 IRaf= 990000000 NMat=       1 IRICut=       1 DoRegI=T DoRafI=F ISym2E= 0 IDoP0=0 IntGTp=1.
 FoFCou: FMM=F IPFlag=           0 FMFlag=      100000 FMFlg1=           0
         NFxFlg=           0 DoJE=F BraDBF=F KetDBF=F FulRan=T
         wScrn=  0.000000 ICntrl=         0 IOpCl=  0 I1Cent=           0 NGrid=           0
         NMat0=    1 NMatS0=      1 NMatT0=    0 NMatD0=    1 NMtDS0=    0 NMtDT0=    0
 Symmetry not used in FoFCou.
 E= -388.378353067121    
 DIIS: error= 1.67D-03 at cycle   1 NSaved=   1.
 NSaved= 1 IEnMin= 1 EnMin= -388.378353067121     IErMin= 1 ErrMin= 1.67D-03
 ErrMax= 1.67D-03  0.00D+00 EMaxC= 1.00D-01 BMatC= 4.02D-03 BMatP= 4.02D-03
 IDIUse=3 WtCom= 9.83D-01 WtEn= 1.67D-02
 Coeff-Com:  0.100D+01
 Coeff-En:   0.100D+01
 Coeff:      0.100D+01
 Gap=     0.225 Goal=   None    Shift=    0.000
 GapD=    0.225 DampG=1.000 DampE=1.000 DampFc=1.0000 IDamp=-1.
 RMSDP=7.99D-02 MaxDP=5.90D+00              OVMax= 1.23D-02

 Cycle   2  Pass 1  IDiag  1:
 RMSU=  6.13D-02    CP:  1.90D+00
 E= -388.381632186273     Delta-E=       -0.003279119153 Rises=F Damp=F
 DIIS: error= 2.28D-04 at cycle   2 NSaved=   2.
 NSaved= 2 IEnMin= 2 EnMin= -388.381632186273     IErMin= 2 ErrMin= 2.28D-04
 ErrMax= 2.28D-04  0.00D+00 EMaxC= 1.00D-01 BMatC= 2.96D-05 BMatP= 4.02D-03
 IDIUse=3 WtCom= 9.98D-01 WtEn= 2.28D-03
 Coeff-Com:  0.934D-02 0.991D+00
 Coeff-En:   0.000D+00 0.100D+01
 Coeff:      0.931D-02 0.991D+00
 Gap=     0.220 Goal=   None    Shift=    0.000
 RMSDP=2.70D-03 MaxDP=2.14D-01 DE=-3.28D-03 OVMax= 2.75D-03

 Cycle   3  Pass 1  IDiag  1:
 RMSU=  6.57D-04    CP:  1.92D+00  1.04D+00
 E= -388.381637582581     Delta-E=       -0.000005396308 Rises=F Damp=F
 DIIS: error= 1.63D-04 at cycle   3 NSaved=   3.
 NSaved= 3 IEnMin= 3 EnMin= -388.381637582581     IErMin= 3 ErrMin= 1.63D-04
 ErrMax= 1.63D-04  0.00D+00 EMaxC= 1.00D-01 BMatC= 2.65D-05 BMatP= 2.96D-05
 IDIUse=3 WtCom= 9.98D-01 WtEn= 1.63D-03
 Coeff-Com: -0.560D-02 0.484D+00 0.521D+00
 Coeff-En:   0.000D+00 0.452D+00 0.548D+00
 Coeff:     -0.559D-02 0.484D+00 0.521D+00
 Gap=     0.220 Goal=   None    Shift=    0.000
 RMSDP=2.49D-04 MaxDP=1.05D-02 DE=-5.40D-06 OVMax= 1.54D-03

 Cycle   4  Pass 1  IDiag  1:
 RMSU=  1.32D-04    CP:  1.92D+00  1.04D+00  9.20D-01
 E= -388.381666301432     Delta-E=       -0.000028718851 Rises=F Damp=F
 DIIS: error= 3.47D-05 at cycle   4 NSaved=   4.
 NSaved= 4 IEnMin= 4 EnMin= -388.381666301432     IErMin= 4 ErrMin= 3.47D-05
 ErrMax= 3.47D-05  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.10D-06 BMatP= 2.65D-05
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.274D-02 0.118D+00 0.218D+00 0.667D+00
 Coeff:     -0.274D-02 0.118D+00 0.218D+00 0.667D+00
 Gap=     0.220 Goal=   None    Shift=    0.000
 RMSDP=6.62D-05 MaxDP=4.32D-03 DE=-2.87D-05 OVMax= 6.14D-04

 Cycle   5  Pass 1  IDiag  1:
 RMSU=  3.86D-05    CP:  1.92D+00  1.04D+00  8.98D-01  9.49D-01
 E= -388.381667068319     Delta-E=       -0.000000766887 Rises=F Damp=F
 DIIS: error= 1.89D-05 at cycle   5 NSaved=   5.
 NSaved= 5 IEnMin= 5 EnMin= -388.381667068319     IErMin= 5 ErrMin= 1.89D-05
 ErrMax= 1.89D-05  0.00D+00 EMaxC= 1.00D-01 BMatC= 4.04D-07 BMatP= 1.10D-06
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.125D-02 0.308D-01 0.967D-01 0.438D+00 0.436D+00
 Coeff:     -0.125D-02 0.308D-01 0.967D-01 0.438D+00 0.436D+00
 Gap=     0.220 Goal=   None    Shift=    0.000
 RMSDP=1.71D-05 MaxDP=1.18D-03 DE=-7.67D-07 OVMax= 3.03D-04

 Cycle   6  Pass 1  IDiag  1:
 RMSU=  7.53D-06    CP:  1.92D+00  1.04D+00  9.06D-01  9.49D-01  7.26D-01
 E= -388.381667523071     Delta-E=       -0.000000454752 Rises=F Damp=F
 DIIS: error= 3.70D-06 at cycle   6 NSaved=   6.
 NSaved= 6 IEnMin= 6 EnMin= -388.381667523071     IErMin= 6 ErrMin= 3.70D-06
 ErrMax= 3.70D-06  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.28D-08 BMatP= 4.04D-07
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.348D-03 0.340D-02 0.258D-01 0.138D+00 0.208D+00 0.625D+00
 Coeff:     -0.348D-03 0.340D-02 0.258D-01 0.138D+00 0.208D+00 0.625D+00
 Gap=     0.220 Goal=   None    Shift=    0.000
 RMSDP=3.41D-06 MaxDP=1.31D-04 DE=-4.55D-07 OVMax= 4.65D-05

 Cycle   7  Pass 1  IDiag  1:
 RMSU=  2.48D-06    CP:  1.92D+00  1.04D+00  9.06D-01  9.51D-01  7.77D-01
                    CP:  8.93D-01
 E= -388.381667535565     Delta-E=       -0.000000012494 Rises=F Damp=F
 DIIS: error= 1.22D-06 at cycle   7 NSaved=   7.
 NSaved= 7 IEnMin= 7 EnMin= -388.381667535565     IErMin= 7 ErrMin= 1.22D-06
 ErrMax= 1.22D-06  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.50D-09 BMatP= 1.28D-08
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.782D-04-0.693D-03 0.562D-02 0.362D-01 0.762D-01 0.321D+00
 Coeff-Com:  0.562D+00
 Coeff:     -0.782D-04-0.693D-03 0.562D-02 0.362D-01 0.762D-01 0.321D+00
 Coeff:      0.562D+00
 Gap=     0.220 Goal=   None    Shift=    0.000
 RMSDP=1.79D-06 MaxDP=1.06D-04 DE=-1.25D-08 OVMax= 1.12D-05

 Cycle   8  Pass 1  IDiag  1:
 RMSU=  8.37D-07    CP:  1.92D+00  1.04D+00  9.07D-01  9.52D-01  7.55D-01
                    CP:  8.99D-01  6.55D-01
 E= -388.381667536935     Delta-E=       -0.000000001370 Rises=F Damp=F
 DIIS: error= 2.77D-07 at cycle   8 NSaved=   8.
 NSaved= 8 IEnMin= 8 EnMin= -388.381667536935     IErMin= 8 ErrMin= 2.77D-07
 ErrMax= 2.77D-07  0.00D+00 EMaxC= 1.00D-01 BMatC= 8.24D-11 BMatP= 1.50D-09
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.613D-06-0.456D-03-0.183D-03 0.157D-02 0.104D-01 0.561D-01
 Coeff-Com:  0.228D+00 0.704D+00
 Coeff:      0.613D-06-0.456D-03-0.183D-03 0.157D-02 0.104D-01 0.561D-01
 Coeff:      0.228D+00 0.704D+00
 Gap=     0.220 Goal=   None    Shift=    0.000
 RMSDP=5.68D-07 MaxDP=4.04D-05 DE=-1.37D-09 OVMax= 2.68D-06

 Cycle   9  Pass 1  IDiag  1:
 RMSU=  2.76D-07    CP:  1.92D+00  1.04D+00  9.07D-01  9.52D-01  7.59D-01
                    CP:  8.92D-01  7.02D-01  8.91D-01
 E= -388.381667536969     Delta-E=       -0.000000000033 Rises=F Damp=F
 DIIS: error= 7.85D-08 at cycle   9 NSaved=   9.
 NSaved= 9 IEnMin= 9 EnMin= -388.381667536969     IErMin= 9 ErrMin= 7.85D-08
 ErrMax= 7.85D-08  0.00D+00 EMaxC= 1.00D-01 BMatC= 9.16D-12 BMatP= 8.24D-11
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.403D-05-0.226D-03-0.398D-03-0.947D-03 0.214D-02 0.148D-01
 Coeff-Com:  0.997D-01 0.384D+00 0.501D+00
 Coeff:      0.403D-05-0.226D-03-0.398D-03-0.947D-03 0.214D-02 0.148D-01
 Coeff:      0.997D-01 0.384D+00 0.501D+00
 Gap=     0.220 Goal=   None    Shift=    0.000
 RMSDP=8.95D-08 MaxDP=6.58D-06 DE=-3.33D-11 OVMax= 1.29D-06

 Cycle  10  Pass 1  IDiag  1:
 RMSU=  6.24D-08    CP:  1.92D+00  1.04D+00  9.07D-01  9.52D-01  7.60D-01
                    CP:  8.92D-01  7.02D-01  9.13D-01  9.48D-01
 E= -388.381667537049     Delta-E=       -0.000000000080 Rises=F Damp=F
 DIIS: error= 2.63D-08 at cycle  10 NSaved=  10.
 NSaved=10 IEnMin=10 EnMin= -388.381667537049     IErMin=10 ErrMin= 2.63D-08
 ErrMax= 2.63D-08  0.00D+00 EMaxC= 1.00D-01 BMatC= 6.73D-13 BMatP= 9.16D-12
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.195D-05-0.774D-04-0.190D-03-0.631D-03 0.302D-03 0.263D-02
 Coeff-Com:  0.317D-01 0.135D+00 0.262D+00 0.570D+00
 Coeff:      0.195D-05-0.774D-04-0.190D-03-0.631D-03 0.302D-03 0.263D-02
 Coeff:      0.317D-01 0.135D+00 0.262D+00 0.570D+00
 Gap=     0.220 Goal=   None    Shift=    0.000
 RMSDP=2.65D-08 MaxDP=1.82D-06 DE=-7.99D-11 OVMax= 4.89D-07

 Cycle  11  Pass 1  IDiag  1:
 RMSU=  1.70D-08    CP:  1.92D+00  1.04D+00  9.07D-01  9.52D-01  7.60D-01
                    CP:  8.93D-01  7.02D-01  9.16D-01  9.64D-01  8.83D-01
 E= -388.381667537064     Delta-E=       -0.000000000016 Rises=F Damp=F
 DIIS: error= 1.23D-08 at cycle  11 NSaved=  11.
 NSaved=11 IEnMin=11 EnMin= -388.381667537064     IErMin=11 ErrMin= 1.23D-08
 ErrMax= 1.23D-08  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.44D-13 BMatP= 6.73D-13
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.485D-06-0.107D-04-0.492D-04-0.226D-03-0.107D-03-0.754D-03
 Coeff-Com:  0.348D-02 0.201D-01 0.797D-01 0.354D+00 0.544D+00
 Coeff:      0.485D-06-0.107D-04-0.492D-04-0.226D-03-0.107D-03-0.754D-03
 Coeff:      0.348D-02 0.201D-01 0.797D-01 0.354D+00 0.544D+00
 Gap=     0.220 Goal=   None    Shift=    0.000
 RMSDP=1.24D-08 MaxDP=6.61D-07 DE=-1.58D-11 OVMax= 1.79D-07

 Cycle  12  Pass 1  IDiag  1:
 RMSU=  5.25D-09    CP:  1.92D+00  1.04D+00  9.07D-01  9.52D-01  7.60D-01
                    CP:  8.93D-01  7.03D-01  9.18D-01  9.70D-01  9.00D-01
                    CP:  7.52D-01
 E= -388.381667537010     Delta-E=        0.000000000054 Rises=F Damp=F
 DIIS: error= 2.01D-09 at cycle  12 NSaved=  12.
 NSaved=12 IEnMin=11 EnMin= -388.381667537064     IErMin=12 ErrMin= 2.01D-09
 ErrMax= 2.01D-09  0.00D+00 EMaxC= 1.00D-01 BMatC= 5.09D-15 BMatP= 1.44D-13
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.816D-07 0.118D-05-0.848D-05-0.646D-04-0.865D-04-0.633D-03
 Coeff-Com: -0.107D-02-0.221D-02 0.137D-01 0.110D+00 0.239D+00 0.641D+00
 Coeff:      0.816D-07 0.118D-05-0.848D-05-0.646D-04-0.865D-04-0.633D-03
 Coeff:     -0.107D-02-0.221D-02 0.137D-01 0.110D+00 0.239D+00 0.641D+00
 Gap=     0.220 Goal=   None    Shift=    0.000
 RMSDP=3.27D-09 MaxDP=2.19D-07 DE= 5.45D-11 OVMax= 1.93D-08

 SCF Done:  E(RB3LYP) =  -388.381667537     A.U. after   12 cycles
            NFock= 12  Conv=0.33D-08     -V/T= 2.0060
 KE= 3.860474937157D+02 PE=-1.907650553478D+03 EE= 6.290777106486D+02
 Leave Link  502 at Thu Jul  8 18:28:08 2021, MaxMem= 10737418240 cpu:            1871.0 elap:             117.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l801.exe)
 DoSCS=F DFT=T ScalE2(SS,OS)=  1.000000  1.000000
 Range of M.O.s used for correlation:     1   338
 NBasis=   338 NAE=    36 NBE=    36 NFC=     0 NFV=     0
 NROrb=    338 NOA=    36 NOB=    36 NVA=   302 NVB=   302

 **** Warning!!: The largest alpha MO coefficient is  0.10405710D+03

 Leave Link  801 at Thu Jul  8 18:28:08 2021, MaxMem= 10737418240 cpu:               1.0 elap:               0.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1002.exe)
 Minotr:  Closed shell wavefunction.
          Direct CPHF calculation.
          Differentiating once with respect to electric field.
                with respect to dipole field.
                with respect to quadrupole field.
          Differentiating once with respect to magnetic field using GIAOs.
          Electric field/nuclear overlap derivatives assumed to be zero.
          Requested convergence is 1.0D-08 RMS, and 1.0D-07 maximum.
          Secondary convergence is 1.0D-12 RMS, and 1.0D-12 maximum.
          NewPWx=F KeepS1=T KeepF1=T KeepIn=T MapXYZ=F SortEE=F KeepMc=T.
         6795 words used for storage of precomputed grid.
 Two-electron integral symmetry used by symmetrizing perturbed Fock matrices.
          MDV=   10737418240 using IRadAn=       1.
          Solving linear equations simultaneously, MaxMat=     384.
          Doing perturbations at frequencies    0.085645
 FoFCou: FMM=F IPFlag=           0 FMFlag=      100000 FMFlg1=           0
         NFxFlg=           0 DoJE=F BraDBF=F KetDBF=T FulRan=T
         wScrn=  0.000000 ICntrl=      6100 IOpCl=  0 I1Cent=           7 NGrid=          22
         NMat0=    1 NMatS0=      1 NMatT0=    0 NMatD0=    1 NMtDS0=    0 NMtDT0=    0
 Symmetry not used in FoFCou.
 FoFJK:  IHMeth= 1 ICntrl=    6127 DoSepK=F KAlg= 0 I1Cent=           0 FoldK=F
 IRaf=         1 NMat=       1 IRICut=       1 DoRegI=T DoRafI=F ISym2E= 0 IDoP0=0 IntGTp=1.
 CalDSu exits because no D1Ps are significant.
          There are    12 degrees of freedom in the 1st order CPHF.  IDoFFX=0 NUNeed=    12.
     11 vectors produced by pass  0 Test12= 1.81D-13 8.33D-09 XBig12= 1.00D+00 5.21D-01.
 AX will form    11 AO Fock derivatives at one time.
     11 vectors produced by pass  1 Test12= 1.81D-13 8.33D-09 XBig12= 4.33D-01 1.13D-01.
     11 vectors produced by pass  2 Test12= 1.81D-13 8.33D-09 XBig12= 6.24D-02 6.92D-02.
     11 vectors produced by pass  3 Test12= 1.81D-13 8.33D-09 XBig12= 3.69D-03 1.79D-02.
     11 vectors produced by pass  4 Test12= 1.81D-13 8.33D-09 XBig12= 9.29D-04 7.75D-03.
     11 vectors produced by pass  5 Test12= 1.81D-13 8.33D-09 XBig12= 3.62D-05 1.02D-03.
     11 vectors produced by pass  6 Test12= 1.81D-13 8.33D-09 XBig12= 5.97D-07 9.69D-05.
     11 vectors produced by pass  7 Test12= 1.81D-13 8.33D-09 XBig12= 6.53D-09 1.10D-05.
     11 vectors produced by pass  8 Test12= 1.81D-13 8.33D-09 XBig12= 5.33D-11 1.01D-06.
      6 vectors produced by pass  9 Test12= 1.81D-13 8.33D-09 XBig12= 5.49D-13 1.14D-07.
      2 vectors produced by pass 10 Test12= 1.81D-13 8.33D-09 XBig12= 1.78D-14 1.79D-08.
      1 vectors produced by pass 11 Test12= 1.81D-13 8.33D-09 XBig12= 2.57D-14 2.39D-08.
 InvSVY:  IOpt=1 It=  1 EMax= 5.68D-14
 Solved reduced A of dimension   108 with    12 vectors.
 FullF1:  Do perturbations      1 to      12.
 SCF Polarizability for W=    0.085645:
                1             2             3 
      1  0.150965D+03
      2  0.204140D+01  0.131534D+03
      3 -0.374916D+01  0.139921D+01  0.825280D+02
 Isotropic polarizability for W=    0.085645      121.68 Bohr**3.
 Dipole-quadrupole polarizability for W=    0.085645:
                 1             2             3 
      1  -0.785182D+02 -0.170177D+02  0.145421D+02
      2   0.415405D+02  0.297206D+01 -0.144033D+02
      3   0.369777D+02  0.140457D+02 -0.138853D+00
      4  -0.294998D+02 -0.338898D+02 -0.114866D+02
      5   0.145997D+02 -0.148645D+02  0.321895D+02
      6  -0.817230D+01 -0.159724D+01  0.220768D+00
 Dipole-magnetic dipole polarizability for W=    0.085645:
                 1             2             3 
      1   0.594274D+00  0.118599D+01  0.225830D+01
      2   0.109170D+02 -0.625041D+01  0.124606D+02
      3   0.846430D+00  0.345263D+02  0.557830D+01
 DQ contribution to OR G for W=    0.085645:
                 1             2             3 
      1  -0.337781D+01  0.128061D+02  0.138249D+02
      2  -0.575776D-01 -0.331435D+01 -0.478823D+01
      3  -0.124821D+02  0.754303D+02  0.669216D+01
 Optical Rotation G' tensor for W=    0.085645:
                 1             2             3 
      1  -0.118051D+01 -0.143219D+01 -0.608328D+00
      2  -0.143219D+01  0.225770D+01 -0.291646D+01
      3  -0.608328D+00 -0.291646D+01 -0.115503D+01
 OR G Eigenvalues:    -3.5201    -0.6624     4.1047  Iso=     0.0259
 Eigenvectors:
   (1)   0.486605   0.486791   0.725431
   (2)   0.854372  -0.091814  -0.511486
   (3)  -0.182382   0.868680  -0.460578
 w=    0.085645 a.u., Optical Rotation Beta=      0.0259 au.
 Molar Mass =    132.2048 grams/mole, [Alpha] ( 5320.0 A) =        9.31 deg.
 PxScal for PaGxPb-FJK:  IOpCl= 0 ISclPx=1 IMOff=     1 NMtTot=    25 NTT=   57291 ScalPx= 2.69D+02
 PxSclF for G(T1ab):  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    36 NTT=   57291 IRwP= 19996     0 IPTmp= 19977     0 ScalPx= 2.69D+03
 FullF1:  Do perturbations      1 to      30.
          There are    36 degrees of freedom in the 2nd order CPHF.
     30 vectors produced by pass  0 Test12= 3.02D-14 2.78D-09 XBig12= 1.00D+00 4.38D-01.
     30 vectors produced by pass  1 Test12= 3.02D-14 2.78D-09 XBig12= 1.81D-02 2.32D-02.
     30 vectors produced by pass  2 Test12= 3.02D-14 2.78D-09 XBig12= 6.59D-04 6.25D-03.
     30 vectors produced by pass  3 Test12= 3.02D-14 2.78D-09 XBig12= 1.85D-05 4.19D-04.
     30 vectors produced by pass  4 Test12= 3.02D-14 2.78D-09 XBig12= 1.51D-07 5.56D-05.
     30 vectors produced by pass  5 Test12= 3.02D-14 2.78D-09 XBig12= 6.25D-10 1.91D-06.
     30 vectors produced by pass  6 Test12= 3.02D-14 2.78D-09 XBig12= 1.93D-12 1.42D-07.
      8 vectors produced by pass  7 Test12= 3.02D-14 2.78D-09 XBig12= 7.57D-15 1.11D-08.
      2 vectors produced by pass  8 Test12= 3.02D-14 2.78D-09 XBig12= 1.43D-15 3.71D-09.
 InvSVY:  IOpt=1 It=  1 EMax= 2.44D-15
 Solved reduced A of dimension   220 with    30 vectors.
 PxScal for FxTab-FJK:  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    30 NTT=   57291 ScalPx= 7.35D+03
 PxScal for FxTab-XC:  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    30 NTT=   57291 ScalPx= 7.35D+03
 PxSclF for G(Xab):  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    36 NTT=   57291 IRwP= 19978     0 IPTmp= 19973     0 ScalPx= 6.98D+03
 FullF1:  Do perturbations      1 to      30.
 End of Minotr F.D. properties on file   721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) frequency  1    0.085645:
                 1             2             3 
      1   0.150965D+03  0.204140D+01 -0.374916D+01
      2   0.204140D+01  0.131534D+03  0.139921D+01
      3  -0.374916D+01  0.139921D+01  0.825280D+02
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.085645:
                 1             2             3 
      1   0.594274D+00  0.118599D+01  0.225830D+01
      2   0.109170D+02 -0.625041D+01  0.124606D+02
      3   0.846430D+00  0.345263D+02  0.557830D+01
 Property number 4 -- D-Q polarizability frequency  1    0.085645:
                 1             2             3 
      1  -0.785182D+02 -0.170177D+02  0.145421D+02
      2   0.415405D+02  0.297206D+01 -0.144033D+02
      3   0.369777D+02  0.140457D+02 -0.138853D+00
      4  -0.294998D+02 -0.338898D+02 -0.114866D+02
      5   0.145997D+02 -0.148645D+02  0.321895D+02
      6  -0.817230D+01 -0.159724D+01  0.220768D+00
 End of Minotr F.D. properties on file   722 Mask=       B NFrqRd=     1 NDeriv=    66 ND12= 1 LenFil=    2379:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1   0.127563D+01 -0.116500D+01 -0.948715D+00 -0.665283D+01 -0.248537D+00
      2  -0.116500D+01 -0.295529D+01 -0.787586D+00 -0.248537D+00 -0.237876D+01
      3  -0.948715D+00 -0.787586D+00 -0.160034D+01  0.751143D+00  0.618032D+00
                 6             7             8             9            10 
      1   0.751143D+00 -0.152872D+01 -0.128048D+00 -0.376598D+01 -0.566647D+01
      2   0.618032D+00 -0.128048D+00  0.530581D+00 -0.409651D+01  0.991047D+00
      3  -0.319970D+01 -0.376598D+01 -0.409651D+01 -0.331748D-01 -0.588161D+00
                11            12            13            14            15 
      1   0.991047D+00 -0.588161D+00  0.249612D+01  0.309202D+01  0.174735D+00
      2  -0.292805D+01 -0.241268D-01  0.309202D+01  0.245064D+01 -0.513259D+00
      3  -0.241268D-01 -0.318951D+01  0.174735D+00 -0.513259D+00  0.112432D+01
                16            17            18            19            20 
      1  -0.593364D+00  0.674284D+00 -0.573666D+01  0.132353D+01 -0.360782D+01
      2   0.674284D+00  0.324373D+00  0.773645D+00 -0.360782D+01 -0.393758D+01
      3  -0.573666D+01  0.773645D+00  0.154573D+01 -0.211839D+00  0.565614D+00
                21            22            23            24            25 
      1  -0.211839D+00  0.580245D+01 -0.677072D+00 -0.125964D+00  0.467604D+00
      2   0.565614D+00 -0.677072D+00  0.598920D+00 -0.505932D+00  0.992523D+00
      3  -0.413817D+00 -0.125964D+00 -0.505932D+00  0.270711D+01 -0.249238D+01
                26            27            28            29            30 
      1   0.992523D+00 -0.249238D+01  0.796984D+00  0.317735D+01 -0.400052D+00
      2  -0.515374D+00  0.372381D+01  0.317735D+01  0.762872D+01 -0.222389D+00
      3   0.372381D+01  0.156349D+01 -0.400052D+00 -0.222389D+00  0.191219D+01
                31            32            33            34            35 
      1   0.134786D+02  0.465664D+01 -0.120510D+01  0.176140D+01 -0.365045D+00
      2   0.465664D+01  0.730059D+01 -0.680353D+00 -0.365045D+00 -0.328726D+00
      3  -0.120510D+01 -0.680353D+00  0.166664D+01  0.154604D+01  0.302788D+01
                36            37            38            39            40 
      1   0.154604D+01  0.174812D+02 -0.197257D+01 -0.239433D+01 -0.661500D+01
      2   0.302788D+01 -0.197257D+01  0.413059D+01  0.299664D-01 -0.343213D+01
      3   0.179385D-03 -0.239433D+01  0.299664D-01  0.252358D+01  0.467925D-01
                41            42            43            44            45 
      1  -0.343213D+01  0.467925D-01 -0.178052D+01 -0.553224D+00  0.323398D+01
      2  -0.632675D+00  0.583718D+00 -0.553224D+00  0.339965D+00 -0.815085D+00
      3   0.583718D+00  0.296712D+00  0.323398D+01 -0.815085D+00 -0.140092D+01
                46            47            48            49            50 
      1  -0.260087D+01  0.383307D+01  0.442648D+00 -0.659574D+01  0.702274D+00
      2   0.383307D+01  0.264658D+01 -0.312948D+00  0.702274D+00 -0.215022D+01
      3   0.442648D+00 -0.312948D+00  0.112382D+01  0.261925D+00  0.459441D+00
                51            52            53            54            55 
      1   0.261925D+00  0.190317D+00 -0.404297D+00  0.410406D+00 -0.556144D+01
      2   0.459441D+00 -0.404297D+00  0.498723D-01 -0.424017D+01  0.291094D+01
      3  -0.245034D+01  0.410406D+00 -0.424017D+01 -0.130089D+01  0.149990D+01
                56            57            58            59            60 
      1   0.291094D+01  0.149990D+01  0.348248D+01 -0.381221D+01  0.293605D+00
      2  -0.253987D+01  0.300865D+00 -0.381221D+01 -0.211327D+01 -0.170092D+01
      3   0.300865D+00 -0.257384D+01  0.293605D+00 -0.170092D+01  0.833074D+00
                61            62            63            64            65 
      1   0.407268D+01  0.185587D+00 -0.369680D+01 -0.485762D+01 -0.413112D+01
      2   0.185587D+00 -0.239108D+01  0.344757D+00 -0.413112D+01  0.137255D+01
      3  -0.369680D+01  0.344757D+00  0.957583D+01  0.229759D+01  0.746061D+00
                66            67            68            69            70 
      1   0.229759D+01 -0.396510D+01  0.681650D+00  0.979761D+00  0.410571D+01
      2   0.746061D+00  0.681650D+00  0.272460D+01  0.141556D+01  0.190806D+01
      3  -0.149754D+01  0.979761D+00  0.141556D+01  0.516778D+00 -0.278087D+01
                71            72            73            74            75 
      1   0.190806D+01 -0.278087D+01 -0.263896D+01  0.536083D+00 -0.535754D-01
      2   0.172016D+01  0.821192D-01  0.536083D+00 -0.273932D+01  0.111180D+01
      3   0.821192D-01 -0.659399D+01 -0.535754D-01  0.111180D+01 -0.244603D+00
                76            77            78            79            80 
      1  -0.164418D+00 -0.450552D+01  0.117693D+01  0.974023D+00  0.221166D+01
      2  -0.450552D+01 -0.919360D+01 -0.338314D+00  0.221166D+01  0.394731D+00
      3   0.117693D+01 -0.338314D+00 -0.388554D+01 -0.165720D+01 -0.658772D+01
                81            82            83            84            85 
      1  -0.165720D+01 -0.580287D+01 -0.440530D+01  0.222616D+00 -0.419067D+01
      2  -0.658772D+01 -0.440530D+01 -0.378822D+01  0.192987D+00 -0.495672D+01
      3   0.383695D+01  0.222616D+00  0.192987D+00 -0.458725D+00 -0.501284D-01
                86            87            88            89            90 
      1  -0.495672D+01 -0.501284D-01  0.358603D+00  0.178362D+00  0.124226D+00
      2  -0.680346D+01 -0.635647D-02  0.178362D+00 -0.386216D-01  0.122062D+00
      3  -0.635647D-02 -0.537196D+00  0.124226D+00  0.122062D+00  0.419045D-02
                91            92            93            94            95 
      1  -0.137150D+02  0.140153D+01  0.148866D+01  0.155048D+01 -0.183144D+01
      2   0.140153D+01 -0.783156D+00 -0.168867D+00 -0.183144D+01  0.518129D+00
      3   0.148866D+01 -0.168867D+00 -0.867938D+00 -0.311558D+00  0.210970D+00
                96            97            98            99           100 
      1  -0.311558D+00  0.172130D+01 -0.328033D+00 -0.100880D-01 -0.226355D+01
      2   0.210970D+00 -0.328033D+00  0.176184D+00  0.303757D-01  0.253319D+01
      3   0.152733D+00 -0.100880D-01  0.303757D-01  0.798595D-01  0.366990D+00
               101           102           103           104           105 
      1   0.253319D+01  0.366990D+00  0.239694D+01 -0.391256D+01 -0.416308D+00
      2  -0.279341D+01 -0.415273D+00 -0.391256D+01  0.940551D+01  0.101370D+01
      3  -0.415273D+00 -0.394341D+00 -0.416308D+00  0.101370D+01  0.795024D+00
               106           107           108           109           110 
      1   0.331093D+00 -0.557846D+00 -0.109890D+00  0.128911D+01 -0.169305D+01
      2  -0.557846D+00  0.117387D+01  0.174355D+00 -0.169305D+01  0.202166D+01
      3  -0.109890D+00  0.174355D+00  0.559529D-01 -0.143697D+00  0.326053D+00
               111           112           113           114           115 
      1  -0.143697D+00 -0.123656D+01  0.177586D+01  0.140296D+00 -0.212660D+00
      2   0.326053D+00  0.177586D+01 -0.958957D+01 -0.992230D+00  0.259697D+00
      3   0.129134D+00  0.140296D+00 -0.992230D+00 -0.748548D+00 -0.474248D-01
               116           117           118           119           120 
      1   0.259697D+00 -0.474248D-01  0.334297D+01 -0.692194D+00 -0.218518D+01
      2  -0.944029D+00 -0.716611D-01 -0.692194D+00  0.720719D+00  0.113878D+00
      3  -0.716611D-01 -0.143053D+00 -0.218518D+01  0.113878D+00  0.197980D+01
               121           122           123           124           125 
      1  -0.115273D+01  0.175173D+01  0.765115D-01 -0.646035D+01  0.637109D+00
      2   0.175173D+01 -0.442922D+00 -0.968790D+00  0.637109D+00 -0.125502D+01
      3   0.765115D-01 -0.968790D+00 -0.366013D+00  0.437589D+01 -0.732345D+00
               126           127           128           129           130 
      1   0.437589D+01 -0.829203D+01 -0.767582D+00  0.151568D+01 -0.454495D+01
      2  -0.732345D+00 -0.767582D+00  0.321841D+01 -0.434678D+00  0.334700D+01
      3  -0.985836D+01  0.151568D+01 -0.434678D+00  0.182630D+01 -0.551744D+00
               131           132           133           134           135 
      1   0.334700D+01 -0.551744D+00  0.241710D+01 -0.130845D+01  0.982610D+00
      2   0.292754D+01  0.287275D+01 -0.130845D+01  0.344147D+01  0.878000D+00
      3   0.287275D+01 -0.129542D+00  0.982610D+00  0.878000D+00 -0.670933D+01
               136           137           138           139           140 
      1   0.961116D+01  0.347308D+01 -0.182094D+01  0.295386D+01  0.226776D+01
      2   0.347308D+01  0.199037D+01 -0.651586D+00  0.226776D+01  0.167553D+01
      3  -0.182094D+01 -0.651586D+00  0.130020D+01 -0.637200D+00 -0.776944D+00
               141           142           143           144           145 
      1  -0.637200D+00 -0.434133D+01 -0.153250D+01  0.226315D+01  0.162199D+01
      2  -0.776944D+00 -0.153250D+01 -0.137406D+01  0.902135D+00  0.573471D+00
      3   0.471215D+00  0.226315D+01  0.902135D+00 -0.768394D+00  0.135631D+01
               146           147           148           149           150 
      1   0.573471D+00  0.135631D+01  0.118008D+00  0.495221D+00 -0.195187D+00
      2  -0.246180D-01  0.181777D+00  0.495221D+00 -0.939052D-01  0.682896D+00
      3   0.181777D+00  0.881492D+00 -0.195187D+00  0.682896D+00 -0.470172D+00
               151           152           153           154           155 
      1   0.221936D+01  0.594269D-01  0.307243D+01  0.129553D+01  0.963914D+00
      2   0.594269D-01  0.144005D+01  0.681790D+00  0.963914D+00  0.357929D+00
      3   0.307243D+01  0.681790D+00  0.747504D+01 -0.104032D+01 -0.423797D+00
               156           157           158           159           160 
      1  -0.104032D+01  0.103235D+01  0.204912D+01 -0.727398D+00 -0.320054D+01
      2  -0.423797D+00  0.204912D+01  0.593061D+01 -0.280588D+01 -0.248227D+01
      3   0.404718D+00 -0.727398D+00 -0.280588D+01  0.236359D+01  0.171343D+01
               161           162           163           164           165 
      1  -0.248227D+01  0.171343D+01 -0.394843D+00  0.663254D+00  0.726891D+00
      2  -0.580109D+01  0.533396D+01  0.663254D+00 -0.911558D+00 -0.202222D+00
      3   0.533396D+01 -0.654656D+01  0.726891D+00 -0.202222D+00 -0.205090D+00
               166           167           168           169           170 
      1   0.144702D+01  0.145795D+01  0.217330D+00  0.928060D+00  0.309527D+00
      2   0.145795D+01  0.922768D+01  0.277713D+01  0.309527D+00  0.494247D+01
      3   0.217330D+00  0.277713D+01  0.204937D+01  0.618602D+00  0.368085D+01
               171           172           173           174           175 
      1   0.618602D+00  0.172113D+00  0.814521D-01  0.607652D+00  0.741664D+00
      2   0.368085D+01  0.814521D-01 -0.735337D+00  0.256514D+00 -0.243154D+00
      3   0.195493D+01  0.607652D+00  0.256514D+00 -0.123519D+01  0.133661D+00
               176           177           178           179           180 
      1  -0.243154D+00  0.133661D+00  0.159871D+01 -0.625986D+00  0.730343D+00
      2  -0.574835D+00  0.596949D+00 -0.625986D+00  0.155415D+01 -0.143254D+01
      3   0.596949D+00  0.493971D-01  0.730343D+00 -0.143254D+01  0.768555D+01
               181           182           183           184           185 
      1   0.132776D+02 -0.214375D+01 -0.262394D+00  0.959933D+00  0.840478D+00
      2  -0.214375D+01  0.144276D+01 -0.884374D-01  0.840478D+00 -0.448252D+00
      3  -0.262394D+00 -0.884374D-01  0.104017D+01  0.784831D-01 -0.350687D+00
               186           187           188           189           190 
      1   0.784831D-01 -0.183556D+01  0.389856D+00  0.125997D+01  0.305704D+00
      2  -0.350687D+00  0.389856D+00 -0.787721D+00 -0.294783D+00 -0.560016D+00
      3   0.163539D+00  0.125997D+01 -0.294783D+00  0.112066D+00 -0.475737D+00
               191           192           193           194           195 
      1  -0.560016D+00 -0.475737D+00 -0.134190D+01  0.501628D+00 -0.110588D+00
      2  -0.139389D+01 -0.936098D-01  0.501628D+00 -0.833829D+01 -0.159150D+01
      3  -0.936098D-01 -0.440488D+00 -0.110588D+00 -0.159150D+01 -0.140245D+01
               196           197           198 
      1  -0.119294D+01  0.479604D+00 -0.337912D-01
      2   0.479604D+00 -0.265215D+01 -0.148493D+01
      3  -0.337912D-01 -0.148493D+01 -0.535100D+00
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1  -0.139924D+01 -0.235522D+00 -0.500644D+01  0.116865D+01  0.208568D+00
      2   0.905903D+00  0.119641D+01  0.312571D+01 -0.382003D+00 -0.741891D+00
      3  -0.692111D+01 -0.128622D+02 -0.215054D+00  0.827856D+01 -0.320015D+01
                 6             7             8             9            10 
      1  -0.185222D+01 -0.876618D+01  0.324711D+01  0.152117D+01  0.582775D+00
      2   0.839927D+01 -0.238549D+01  0.125301D+02  0.150680D+01  0.209472D+00
      3   0.293802D+00  0.113804D+01  0.227611D+01 -0.588268D+01  0.461523D+01
                11            12            13            14            15 
      1   0.464985D+00  0.926660D+00  0.126626D+01 -0.141313D+01  0.339897D+01
      2  -0.332663D+00  0.100172D+02 -0.230801D+01 -0.173669D+00 -0.192761D+01
      3  -0.967208D+01 -0.118513D+00  0.133552D+02  0.384223D+01 -0.206654D+01
                16            17            18            19            20 
      1   0.254847D+01  0.126254D+02  0.112881D+01  0.137812D+01 -0.888543D+00
      2   0.953860D+01 -0.365190D+01 -0.345368D+01  0.818209D+00 -0.131562D+00
      3   0.109111D+01 -0.340929D+00  0.247791D+01 -0.346173D+01 -0.159272D+02
                21            22            23            24            25 
      1  -0.658621D+00 -0.119668D+01  0.561640D+00 -0.338793D+01  0.399617D+01
      2  -0.155431D+01  0.103128D+01  0.175262D+01 -0.728314D+01 -0.971950D+01
      3  -0.895563D+00 -0.739783D+00  0.117273D+01 -0.302115D+00  0.118890D+01
                26            27            28            29            30 
      1   0.227707D+01 -0.290035D+00 -0.192960D+01  0.199275D+01 -0.118065D+01
      2  -0.107217D+02 -0.930073D+00 -0.351392D+01 -0.156849D+01 -0.682124D+00
      3   0.108876D+01  0.590089D+01 -0.380242D+01  0.609206D+01  0.173127D+01
                31            32            33            34            35 
      1   0.228524D+01  0.641670D+00 -0.136701D+01 -0.247873D+01  0.664227D+01
      2   0.176912D+01 -0.241625D+01 -0.892406D+00 -0.156507D+02 -0.134177D+01
      3   0.978492D+01  0.230679D+02 -0.139065D+01  0.319244D+01 -0.143136D+01
                36            37            38            39            40 
      1   0.375859D+00  0.915968D+00  0.176142D+01  0.125672D+01  0.248476D+01
      2   0.167953D+01 -0.206883D+01 -0.152504D+01  0.233880D+00 -0.949242D+00
      3   0.333974D+01 -0.912005D+01  0.124600D+02  0.184256D+01  0.109019D+02
                41            42            43            44            45 
      1  -0.116949D+00 -0.687307D+00  0.352772D+01  0.105083D+02 -0.258998D+00
      2   0.353456D+00  0.482393D+00 -0.134023D+02  0.664626D+00  0.124467D+01
      3  -0.737206D+01 -0.145236D+01 -0.783588D+00 -0.615393D+01 -0.247393D+01
                46            47            48            49            50 
      1   0.444805D+00 -0.577482D+00  0.493911D+01 -0.737247D+00 -0.110268D+01
      2  -0.294695D+01  0.214512D+01 -0.296992D+01  0.143052D-02  0.101562D+01
      3   0.105371D+02 -0.332175D+01 -0.261971D+01  0.729725D+01 -0.710907D+01
                51            52            53            54            55 
      1  -0.351572D+01  0.485554D+01  0.867247D+00 -0.206366D+01 -0.156872D+01
      2   0.183411D+01 -0.149318D+02  0.190852D+01  0.222955D+01 -0.447279D+00
      3   0.888729D-01 -0.460234D+01  0.982910D+00 -0.552367D+01 -0.235962D+01
                56            57            58            59            60 
      1   0.219869D+01 -0.150499D+01  0.303196D+01 -0.123365D+01 -0.125473D+01
      2   0.128113D+01 -0.190835D+01  0.155952D+01 -0.617090D+01  0.120437D+01
      3  -0.271623D+01 -0.138373D+01  0.129492D+02  0.807248D+01  0.450818D+01
                61            62            63            64            65 
      1  -0.333264D+01  0.621486D+01  0.349910D+01 -0.358990D+01 -0.117418D+01
      2  -0.109339D+02  0.664312D+00  0.147825D+02  0.762016D+01  0.364966D+01
      3  -0.412296D+01  0.795961D+01  0.198488D+01  0.898275D+01 -0.135886D+02
                66            67            68            69            70 
      1   0.187603D+01 -0.164377D+01 -0.364854D+01 -0.247223D+01  0.446750D+01
      2  -0.211941D+01  0.447556D+01  0.345413D+01  0.585825D+00 -0.127748D+02
      3   0.170866D+01 -0.884056D+01 -0.535238D+01 -0.348100D+01  0.116590D+01
                71            72            73            74            75 
      1   0.188001D+01  0.598481D+01  0.625837D+00 -0.304599D+01  0.675353D-01
      2  -0.158062D+01 -0.131665D+02 -0.131045D+01  0.125441D+01  0.155341D+01
      3  -0.475307D+01 -0.334681D+01 -0.843953D+01  0.846287D+00 -0.138187D+01
                76            77            78            79            80 
      1  -0.841141D+00  0.516915D+01  0.758065D+01  0.642728D+01  0.236798D+02
      2   0.320187D+00  0.539568D+00 -0.268771D+01 -0.572993D+01 -0.623654D+01
      3   0.135822D+02 -0.681073D+01  0.388329D+01 -0.609480D+00  0.838201D+01
                81            82            83            84            85 
      1  -0.704430D+01  0.379362D+00  0.392566D+00 -0.236516D+01 -0.145829D+00
      2   0.309573D+01 -0.773091D+00 -0.781934D+00  0.300078D+01 -0.354767D-01
      3   0.155490D+01 -0.136615D+01 -0.495168D+01  0.282403D+00 -0.371787D+01
                86            87            88            89            90 
      1  -0.509288D-01 -0.324212D+01  0.123554D+01  0.167631D+01  0.430095D-01
      2  -0.186156D+00  0.294435D+01 -0.137540D+01 -0.129301D+01 -0.118843D+00
      3  -0.109473D+02  0.110880D+00 -0.301215D+00 -0.749847D+00  0.357179D+00
                91            92            93            94            95 
      1   0.274204D-01 -0.455443D+00  0.655256D+00 -0.227250D+00  0.145751D+00
      2  -0.217162D+01  0.280075D+00  0.612120D+01  0.765564D+00 -0.457916D+00
      3   0.233407D+01 -0.545090D+01 -0.322182D+00 -0.434025D+01  0.181044D+01
                96            97            98            99           100 
      1  -0.506227D+00 -0.532803D+00  0.343499D+00 -0.853384D-01 -0.949126D-01
      2  -0.915926D+00 -0.284988D+01  0.534398D+00 -0.489751D+00 -0.435033D+00
      3   0.621493D+00 -0.519354D+00  0.689443D+00 -0.171074D+00  0.964509D+00
               101           102           103           104           105 
      1   0.190097D+00  0.158804D+01  0.885243D-01  0.406775D+00 -0.433212D+01
      2   0.648717D+00  0.144506D+01  0.447528D+00 -0.185906D+01 -0.254182D+01
      3  -0.298665D+01 -0.377203D+00 -0.109271D+01  0.153550D+02  0.159087D+01
               106           107           108           109           110 
      1  -0.407907D+00  0.174310D+01 -0.385223D+00  0.231766D+00  0.939989D-02
      2  -0.912142D+00  0.636024D+00 -0.190775D+00  0.619288D+00 -0.710930D+00
      3  -0.264508D+00  0.136870D+01 -0.216320D+00 -0.682309D+01  0.562803D+01
               111           112           113           114           115 
      1   0.116150D+01 -0.297054D+00  0.703838D+00 -0.421407D+01 -0.539132D+00
      2   0.335192D+00 -0.949639D+00  0.973538D+00 -0.390262D+00 -0.108718D+01
      3   0.533298D+00  0.851591D+01 -0.125487D+02 -0.124370D+01  0.107068D+01
               116           117           118           119           120 
      1   0.201946D+01 -0.230933D+00 -0.752745D+00 -0.156558D+01  0.909449D+00
      2   0.253246D+00 -0.203203D+00 -0.129370D+01 -0.190362D-01  0.400864D+01
      3  -0.189405D+01  0.676177D-01 -0.118963D+01 -0.371332D+01  0.129992D+01
               121           122           123           124           125 
      1  -0.141386D+01 -0.597521D+00 -0.113924D+01  0.995704D+00  0.283673D+01
      2   0.343165D+00  0.927777D-01 -0.105393D+01  0.242684D+01 -0.543211D+00
      3  -0.266235D+01 -0.969692D+00  0.205973D+01  0.215859D+01  0.245799D+01
               126           127           128           129           130 
      1  -0.370040D+01  0.283845D+01 -0.243025D-01  0.330642D+01 -0.242631D+01
      2  -0.156978D+02  0.866917D+01 -0.233465D+01  0.617285D+01 -0.309089D+01
      3  -0.363960D+00  0.216595D+02 -0.129783D+02 -0.164886D+01 -0.200977D+01
               131           132           133           134           135 
      1   0.960400D+01 -0.160091D+00 -0.121859D+00  0.478100D+01 -0.107919D+02
      2   0.733042D+01  0.132111D+00 -0.635294D+00  0.318999D+01 -0.171047D+02
      3  -0.185889D+02 -0.814155D+01 -0.114210D+01 -0.803870D+01 -0.480405D+01
               136           137           138           139           140 
      1   0.238487D+01  0.565651D+00 -0.257247D+01  0.756188D+00  0.742524D+00
      2  -0.486313D+01 -0.188689D+01  0.605532D+01 -0.180365D+01 -0.189606D+01
      3   0.489919D+01 -0.415673D+01 -0.986914D+00  0.684693D+00 -0.215098D+01
               141           142           143           144           145 
      1  -0.153035D+01 -0.279718D+01  0.113841D+00  0.121955D+01 -0.109123D+01
      2   0.197276D+01  0.422003D+01  0.196010D+01 -0.272815D+01  0.170944D+01
      3   0.121203D+01 -0.232014D+01  0.306196D+01  0.823711D+00 -0.328969D+00
               146           147           148           149           150 
      1   0.215754D+00 -0.135363D+01  0.246995D+00 -0.129228D+01 -0.340734D+00
      2  -0.286557D+00  0.310523D+01 -0.894154D+00  0.111323D+01 -0.919921D+00
      3  -0.176158D+00  0.133660D+01  0.195592D+01  0.223692D+01 -0.152286D+01
               151           152           153           154           155 
      1  -0.378439D+01  0.277489D+01 -0.874051D+01  0.204702D+01  0.397119D+00
      2   0.313066D+01  0.161142D+01  0.166721D+02  0.478599D+00 -0.346789D+00
      3   0.374803D+01 -0.558377D+01  0.207219D+01  0.458470D+01  0.330403D+00
               156           157           158           159           160 
      1  -0.966885D+00  0.165170D+01  0.392239D+01 -0.691329D+01 -0.396553D+01
      2   0.140526D+01 -0.214452D-01 -0.209578D+01  0.215034D+01 -0.265289D+00
      3  -0.226545D+01  0.175099D+01 -0.329162D+00  0.628070D+00 -0.681515D+01
               161           162           163           164           165 
      1  -0.950168D+01  0.148041D+02 -0.105776D+01  0.686492D+00  0.509923D+00
      2   0.432208D+01 -0.541750D+01  0.186399D+00 -0.350588D+00  0.660710D+00
      3  -0.566653D+00 -0.765366D+00 -0.107114D+01 -0.375428D+00  0.165970D+01
               166           167           168           169           170 
      1  -0.183648D+01 -0.813001D+01 -0.771834D+01 -0.183499D+01 -0.833524D+01
      2  -0.281185D+00  0.238522D+01  0.169821D+01 -0.577673D+00  0.254053D+01
      3   0.496558D+01 -0.469505D+01 -0.225086D+01  0.432508D+01 -0.419844D+01
               171           172           173           174           175 
      1  -0.657517D+01  0.797916D+00 -0.526978D+00 -0.189232D+01 -0.678655D-01
      2   0.131893D+01  0.216184D+01  0.546102D+00 -0.251671D+01  0.303156D+00
      3  -0.219477D+01 -0.288178D+00  0.157542D+01 -0.162442D+01  0.119912D+01
               176           177           178           179           180 
      1   0.107811D+01 -0.116946D+01  0.460541D+00  0.138976D+01  0.137902D+02
      2   0.134398D+01 -0.239033D+00 -0.241221D+01 -0.318519D+01  0.196558D+02
      3   0.167571D+01 -0.142850D+01 -0.149186D+01 -0.366087D+01  0.373014D+01
               181           182           183           184           185 
      1  -0.174186D+00  0.137610D+00  0.207007D+01  0.248980D+00 -0.688919D+00
      2  -0.414308D+01 -0.614772D-01  0.635032D+01  0.217357D+00 -0.986434D+00
      3  -0.183597D+02 -0.467671D+01  0.103215D+01 -0.187537D+01  0.620096D-01
               186           187           188           189           190 
      1  -0.459256D+00  0.143422D+01  0.314376D+00  0.253612D+00 -0.996031D+00
      2   0.546908D+00  0.212893D+01 -0.410838D+00  0.244713D+00 -0.128601D+01
      3   0.109992D+01  0.167620D+01  0.190479D+01 -0.935249D+00  0.393158D+01
               191           192           193           194           195 
      1  -0.518508D+00 -0.176554D+01 -0.521156D+00 -0.560848D+01 -0.598283D+01
      2   0.336593D-01 -0.574292D+00 -0.518166D+00 -0.337046D+01 -0.309889D+01
      3   0.485389D+01  0.171496D+01  0.553966D+01  0.238017D+02  0.530273D+01
               196           197           198 
      1  -0.364695D+00 -0.233024D+01 -0.175574D+01
      2  -0.128397D+01 -0.287340D+01 -0.104908D+01
      3   0.221771D+01  0.719933D+01  0.436872D+01
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1   0.778327D+00 -0.251416D+02 -0.169004D+01  0.305337D+02  0.629572D+01
      2  -0.517346D+01  0.176380D+02 -0.733427D+00 -0.313845D+02 -0.122078D+02
      3   0.439513D+01  0.750354D+01  0.242346D+01  0.850768D+00  0.591204D+01
      4  -0.202719D+02  0.640135D+01  0.547698D+01  0.675835D+01 -0.146127D+02
      5   0.146808D+01  0.601846D+01  0.790916D+01  0.605136D+00 -0.301835D+01
      6   0.507313D+01  0.229467D+01  0.114031D+02 -0.321065D+01  0.629504D+00
                 6             7             8             9            10 
      1   0.917124D+00  0.681811D+01  0.675715D+01  0.198845D+01 -0.967240D+01
      2   0.684775D+00 -0.491201D+01 -0.580369D+01 -0.868111D+01  0.405954D+01
      3  -0.160190D+01 -0.190610D+01 -0.953458D+00  0.669266D+01  0.561286D+01
      4  -0.421054D+01  0.476434D+01 -0.245161D+01  0.176568D+02  0.501571D+01
      5   0.179733D+02  0.251098D+02  0.194352D+02  0.269832D+01  0.106691D+02
      6   0.573708D+01  0.111052D+02  0.166016D+02 -0.241701D+01 -0.102173D+01
                11            12            13            14            15 
      1   0.347181D+01  0.758832D+01 -0.137495D+02 -0.250043D+02 -0.238900D+01
      2  -0.124357D+01 -0.382954D+01  0.119510D+02  0.256915D+02  0.412839D+01
      3  -0.222825D+01 -0.375878D+01  0.179850D+01 -0.687246D+00 -0.173939D+01
      4   0.258422D+02 -0.118516D+01 -0.291689D+02  0.834635D+01  0.322396D+01
      5  -0.183220D+01  0.218056D+02 -0.683412D+01  0.237618D+01 -0.435622D+01
      6  -0.114286D+01 -0.238976D+01  0.260743D+01 -0.119100D+01 -0.788359D+01
                16            17            18            19            20 
      1   0.111283D+02 -0.402692D+01  0.158105D+02  0.125332D+02  0.204653D+02
      2  -0.387928D+01  0.268968D+01 -0.218025D+02 -0.115170D+02 -0.139601D+02
      3  -0.724906D+01  0.133724D+01  0.599200D+01 -0.101618D+01 -0.650527D+01
      4  -0.673593D+01 -0.114405D+01 -0.242258D+01  0.106233D+02 -0.132172D+02
      5   0.387231D+02 -0.414217D+01 -0.718469D+01  0.170107D+01 -0.389231D+01
      6  -0.305022D+00  0.521447D+01 -0.169821D+01 -0.205916D+01  0.576192D+01
                21            22            23            24            25 
      1  -0.109821D+01 -0.238938D+02  0.130882D+02  0.109560D+01  0.314338D+00
      2   0.425925D+00  0.233116D+02 -0.224742D+02 -0.444233D+01  0.177680D+01
      3   0.672280D+00  0.582189D+00  0.938607D+01  0.334673D+01 -0.209114D+01
      4  -0.333270D+01  0.993473D+01  0.406394D+01  0.270573D+01 -0.412130D+01
      5  -0.446937D+01 -0.960939D+00  0.318759D+01 -0.144598D+02  0.119381D+02
      6  -0.906891D-01  0.201094D+01 -0.540744D+01  0.850915D+01 -0.768514D+01
                26            27            28            29            30 
      1  -0.187038D+01 -0.436748D+01 -0.809015D+01 -0.267342D+02 -0.247682D+00
      2  -0.311400D+01 -0.594267D+01  0.721183D+01  0.194518D+02 -0.170723D+01
      3   0.498438D+01  0.103102D+02  0.878326D+00  0.728236D+01  0.195491D+01
      4   0.644543D+01 -0.170014D+02 -0.758010D+01 -0.984374D+01 -0.102999D+01
      5  -0.164779D+02 -0.196143D+01 -0.194811D+01 -0.353667D+00 -0.701483D+00
      6   0.136461D+02  0.248638D+01 -0.118520D+01 -0.456746D+01  0.307235D+01
                31            32            33            34            35 
      1  -0.123260D+02 -0.123613D+02 -0.101567D+01  0.195424D+01  0.237599D+00
      2   0.116592D+01  0.121950D+02  0.358637D+00 -0.261531D+01 -0.396579D+00
      3   0.111601D+02  0.166277D+00  0.657036D+00  0.661072D+00  0.158980D+00
      4   0.548702D+01 -0.750798D+01 -0.252118D+01 -0.175786D+01  0.219988D+01
      5  -0.422785D+01 -0.258797D+01  0.241080D+00  0.157634D+01 -0.345576D+01
      6  -0.833708D+01 -0.224233D+01  0.350255D+01  0.225900D+01  0.107421D+02
                36            37            38            39            40 
      1  -0.125604D+02 -0.236719D+02  0.485329D+01 -0.101738D+01 -0.216662D+01
      2   0.288144D+01  0.732245D+01 -0.432647D+00  0.991986D+00  0.478610D+01
      3   0.967895D+01  0.163494D+02 -0.442064D+01  0.253948D-01 -0.261947D+01
      4  -0.184176D+01 -0.668300D+01  0.904231D+01  0.716822D+00 -0.690135D+01
      5   0.208058D+01 -0.996436D+01 -0.495134D+00  0.307487D+01  0.123675D+01
      6  -0.120012D+01  0.315982D+00 -0.219377D+01 -0.165179D+01  0.549452D+01
                41            42            43            44            45 
      1   0.472773D-01  0.991737D+00  0.478169D+01 -0.230107D+01 -0.802327D+01
      2   0.866134D+01  0.123076D+01 -0.114626D+01  0.222533D+01 -0.278656D+01
      3  -0.870862D+01 -0.222250D+01 -0.363543D+01  0.757373D-01  0.108098D+02
      4   0.602213D+01  0.335074D+01 -0.175193D+01  0.405704D+01 -0.118245D+01
      5   0.225746D+01 -0.148953D+00  0.407710D+01  0.153915D+01  0.270558D+00
      6   0.122056D+01 -0.234389D+00 -0.983742D+00  0.505404D+01  0.107975D+01
                46            47            48            49            50 
      1   0.630636D+01  0.103553D+02 -0.718345D+00  0.184966D+01  0.721943D+01
      2  -0.366080D+01 -0.988937D+01  0.170228D+01  0.682348D+01 -0.153736D+02
      3  -0.264556D+01 -0.465898D+00 -0.983939D+00 -0.867314D+01  0.815418D+01
      4   0.894246D+01 -0.212367D+02 -0.202894D+01  0.160475D+02  0.130829D+02
      5   0.571962D+00 -0.209898D+01 -0.696723D+01  0.212583D+01  0.104561D+01
      6  -0.358620D+01  0.263064D+01 -0.990935D+01  0.847901D+00 -0.494963D+01
                51            52            53            54            55 
      1   0.222038D+01 -0.407943D+00  0.794200D-01 -0.172230D+02  0.192501D+02
      2  -0.385258D+01  0.198337D+01 -0.366075D+01  0.433633D+01 -0.454047D+01
      3   0.163220D+01 -0.157543D+01  0.358133D+01  0.128867D+02 -0.147096D+02
      4   0.557228D+00  0.345851D+01  0.464429D+01  0.707477D+01  0.136545D+02
      5   0.160008D+01  0.108791D+01  0.750522D+01  0.531324D+01  0.642400D+01
      6   0.813980D+01 -0.266099D+01  0.175499D+02  0.551550D+01  0.474714D-01
                56            57            58            59            60 
      1   0.121162D+01 -0.933642D+00  0.550358D+01 -0.905889D+01  0.166004D+01
      2   0.239148D+01 -0.460187D+01 -0.417997D+00  0.384230D+00  0.944628D+00
      3  -0.360310D+01  0.553551D+01 -0.508558D+01  0.867466D+01 -0.260467D+01
      4  -0.134009D+02  0.527097D+00 -0.255947D+02 -0.562815D+01 -0.859276D+01
      5   0.165548D+01 -0.125168D+02  0.246808D+01 -0.868844D+01  0.428242D+01
      6  -0.399728D+01  0.388034D+01 -0.671210D+01  0.330714D+01 -0.294657D+01
                61            62            63            64            65 
      1  -0.137957D+02  0.267822D+01  0.378505D+01 -0.187670D+02 -0.199405D+02
      2  -0.127279D+02  0.393611D+01  0.126687D+02  0.324717D+01  0.109363D+02
      3   0.265236D+02 -0.661433D+01 -0.164538D+02  0.155199D+02  0.900417D+01
      4   0.947723D+00 -0.138955D+02  0.559943D+01 -0.245533D+02 -0.671777D+01
      5  -0.187589D+02  0.350120D+01  0.399290D+02  0.156193D+02  0.569378D+01
      6   0.651068D+01 -0.591458D-01 -0.915704D+01  0.680056D+01  0.337512D+01
                66            67            68            69            70 
      1   0.933159D+01 -0.209720D+02  0.839773D+00  0.179901D+01  0.164290D+02
      2  -0.171178D+01  0.110424D+02  0.196539D+01  0.881168D+00  0.477221D-01
      3  -0.761981D+01  0.992962D+01 -0.280516D+01 -0.268018D+01 -0.164767D+02
      4   0.684016D+01 -0.381574D+01  0.128107D+02  0.718696D+01  0.148971D+02
      5  -0.824681D+01  0.709868D+01  0.603778D+01  0.157387D+01 -0.154938D+02
      6  -0.336755D+01  0.469370D+01  0.648388D+01  0.173435D+01 -0.759347D+01
                71            72            73            74            75 
      1   0.793160D+01 -0.987808D+01 -0.558511D+01  0.121044D+02 -0.470140D+01
      2  -0.265862D+01  0.171556D+02  0.884360D+01 -0.723310D+01  0.496478D+01
      3  -0.527298D+01 -0.727751D+01 -0.325849D+01 -0.487129D+01 -0.263371D+00
      4   0.981178D+01 -0.755194D+01  0.420100D+01  0.391351D+01  0.327758D+00
      5  -0.312591D+01 -0.291861D+02 -0.134785D+01  0.123630D+01 -0.192069D+01
      6   0.387710D+01 -0.105091D+02  0.172052D+01  0.721537D+01 -0.108287D+01
                76            77            78            79            80 
      1   0.266996D+02  0.333349D+02 -0.365014D+00 -0.112786D+02 -0.313245D+01
      2  -0.202220D+02 -0.354584D+02 -0.811754D+01  0.742889D+01 -0.853446D+01
      3  -0.647759D+01  0.212355D+01  0.848255D+01  0.384975D+01  0.116669D+02
      4   0.187627D+01 -0.716982D+01  0.492215D+00  0.727116D+00  0.363145D+01
      5   0.313759D+01  0.142852D+01 -0.714471D+01 -0.229271D+01 -0.111180D+02
      6   0.596298D+01 -0.512599D+01 -0.226718D+02 -0.129538D+02 -0.440279D+02
                81            82            83            84            85 
      1   0.300270D+02  0.259099D+02  0.162522D+02 -0.364997D+00  0.103390D+02
      2  -0.287344D+02 -0.449540D+01  0.944568D+00  0.146381D+00  0.816234D+01
      3  -0.129264D+01 -0.214145D+02 -0.171967D+02  0.218615D+00 -0.185014D+02
      4  -0.851149D+01  0.391707D+02  0.348369D+02 -0.127884D+01  0.389249D+02
      5   0.852819D+01 -0.625944D+00 -0.789420D+00  0.535979D+01  0.750495D+00
      6   0.181142D+02 -0.133905D+01 -0.133235D+01  0.288328D+01 -0.212804D+00
                86            87            88            89            90 
      1   0.487707D+01  0.866918D-01 -0.211397D+01 -0.159514D+01 -0.236872D-01
      2   0.179530D+02 -0.336637D+00  0.114269D+01  0.124997D+01  0.111039D+01
      3  -0.228301D+02  0.249945D+00  0.971280D+00  0.345168D+00 -0.108670D+01
      4   0.478327D+02  0.444338D-01 -0.182709D+01 -0.695800D+00  0.142118D+01
      5   0.939744D+00  0.403074D+01  0.781593D+00  0.920238D-01 -0.536894D+00
      6  -0.558633D+00  0.506445D+01  0.628837D+00  0.114332D+01 -0.791162D-01
                91            92            93            94            95 
      1   0.102936D+03 -0.101068D+02 -0.946165D+01 -0.990957D+01  0.104783D+02
      2  -0.600762D+02  0.554777D+01  0.653846D+01  0.479554D+01 -0.523997D+01
      3  -0.428595D+02  0.455898D+01  0.292319D+01  0.511403D+01 -0.523831D+01
      4  -0.145833D+02  0.947065D+01  0.145532D+01  0.173553D+02 -0.487838D+01
      5  -0.137280D+02  0.146286D+01  0.102105D+02  0.261244D+01 -0.175493D+01
      6   0.262352D+00 -0.679012D+00 -0.655034D+00 -0.127755D+01  0.284259D+00
                96            97            98            99           100 
      1   0.153038D+01 -0.127417D+02  0.164882D+01  0.268601D+01  0.578807D+01
      2  -0.113299D+01  0.772197D+01 -0.850481D+00 -0.140241D+01  0.247240D+01
      3  -0.397394D+00  0.501972D+01 -0.798337D+00 -0.128360D+01 -0.826047D+01
      4  -0.181707D+01  0.308584D+01 -0.135673D+01 -0.789546D+00 -0.184684D+02
      5  -0.122000D+01  0.257559D+01 -0.170268D-01 -0.199789D+01 -0.213913D+01
      6   0.203074D+01 -0.216379D+00  0.787447D+00  0.474130D+00  0.187748D+01
               101           102           103           104           105 
      1  -0.457200D+01 -0.552182D+00  0.363075D+00 -0.146789D+02 -0.155730D+01
      2  -0.429598D+01 -0.393223D-01 -0.109399D+02  0.358391D+02  0.256945D+01
      3   0.886798D+01  0.591505D+00  0.105768D+02 -0.211602D+02 -0.101215D+01
      4   0.224042D+02  0.282608D+01  0.258911D+02 -0.483908D+02 -0.495701D+01
      5   0.243445D+01  0.357256D+01  0.255513D+01 -0.378814D+01 -0.408364D+01
      6  -0.226630D+01 -0.230797D+01 -0.275702D+01  0.671763D+01  0.705452D+01
               106           107           108           109           110 
      1  -0.699473D+00 -0.110697D+01 -0.154703D+01 -0.422541D+01  0.790741D+01
      2  -0.792989D+00  0.330322D+01  0.258396D+01  0.641414D+01 -0.990992D+01
      3   0.149246D+01 -0.219625D+01 -0.103693D+01 -0.218874D+01  0.200250D+01
      4   0.427581D+01 -0.609912D+01 -0.167612D+01 -0.350747D+01  0.795611D+01
      5   0.127374D+01 -0.105948D+01 -0.897034D+00  0.413061D+00 -0.336846D-01
      6  -0.138664D+01  0.315728D+01  0.134328D+01  0.125138D+01 -0.238303D+01
               111           112           113           114           115 
      1   0.159057D+01  0.651025D+01 -0.379576D+02 -0.425333D+01  0.100417D+01
      2  -0.115748D+01 -0.837972D+01  0.532164D+02  0.439020D+01 -0.128017D+01
      3  -0.433089D+00  0.186947D+01 -0.152588D+02 -0.136873D+00  0.276004D+00
      4   0.323567D+00  0.594692D+01  0.291823D+01  0.499539D+00  0.362459D+00
      5   0.125887D+01 -0.151559D+00  0.180318D+01  0.342603D+00  0.455834D+00
      6  -0.139484D+01 -0.129780D+01  0.801853D+01  0.715093D+01 -0.335116D+00
               116           117           118           119           120 
      1  -0.354309D+01 -0.149815D+01  0.610029D+01 -0.937962D+00 -0.415833D+01
      2   0.454713D+01  0.200563D+01 -0.929605D+01  0.259602D+00  0.616577D+01
      3  -0.100404D+01 -0.507483D+00  0.319576D+01  0.678360D+00 -0.200744D+01
      4  -0.461796D+00 -0.148908D+01 -0.460906D+01  0.757789D+01  0.172511D+01
      5  -0.611339D+00 -0.753966D+00 -0.118839D+02  0.114992D+01  0.165795D+02
      6   0.282603D+01  0.131579D+01  0.206553D+01  0.491597D-01 -0.176443D+01
               121           122           123           124           125 
      1  -0.353214D+00 -0.182756D+01 -0.223035D+00 -0.142000D+01 -0.977387D+00
      2  -0.803614D+00 -0.492346D+00  0.316212D+00  0.146147D+02 -0.114415D+01
      3   0.115683D+01  0.231990D+01 -0.931771D-01 -0.131947D+02  0.212154D+01
      4   0.109385D+02 -0.329497D+01 -0.404454D+01  0.508957D+01 -0.629033D+01
      5   0.121644D+00 -0.392135D+01 -0.150322D+01  0.257632D+02 -0.398031D+01
      6  -0.173637D+01  0.841084D+00  0.846096D+01 -0.445072D+01  0.538800D+01
               126           127           128           129           130 
      1  -0.131350D+02 -0.639340D+02  0.102698D+02  0.432407D+01 -0.342425D+01
      2  -0.239590D+02  0.364500D+02 -0.141639D+02 -0.465245D+01 -0.436114D+01
      3   0.370939D+02  0.274840D+02  0.389412D+01  0.328375D+00  0.778539D+01
      4  -0.409680D+01  0.146013D+02  0.154553D+02 -0.383731D+01  0.230896D+02
      5  -0.412418D+02  0.565678D+01 -0.184723D+01  0.922172D+01 -0.447128D+01
      6   0.914282D+01 -0.726891D+01  0.293486D+01 -0.608208D+01  0.489961D+01
               131           132           133           134           135 
      1   0.248181D+02  0.541593D+01  0.107235D+02  0.262463D+01  0.165450D+02
      2  -0.277989D+02 -0.117933D+02 -0.131176D+01 -0.130488D+02  0.274379D+00
      3   0.298085D+01  0.637733D+01 -0.941179D+01  0.104242D+02 -0.168194D+02
      4   0.376372D+01  0.133722D+02 -0.108138D+02  0.157800D+02 -0.231922D+01
      5   0.158801D+02 -0.142473D+00  0.710678D+01  0.226683D+01 -0.282702D+02
      6  -0.141389D+02  0.268031D+00 -0.421082D+01 -0.174260D+01  0.186787D+02
               136           137           138           139           140 
      1   0.511113D+02  0.149208D+02 -0.953188D+01  0.111662D+02  0.580045D+01
      2  -0.229774D+02 -0.369285D+01  0.424333D+01 -0.113530D+01  0.290993D+01
      3  -0.281339D+02 -0.112280D+02  0.528855D+01 -0.100308D+02 -0.871037D+01
      4   0.361379D+02  0.208854D+02 -0.688512D+01  0.208462D+02  0.141650D+02
      5  -0.142325D+02 -0.463949D+01  0.109567D+02 -0.434025D+01 -0.513189D+01
      6  -0.592849D+01 -0.298959D+01  0.441771D+01 -0.330096D+01 -0.314537D+01
               141           142           143           144           145 
      1  -0.162846D+01 -0.163530D+02 -0.336501D+01  0.731700D+01  0.729758D+01
      2  -0.640686D+00  0.859176D+01  0.870500D-01 -0.622814D+01 -0.629025D+01
      3   0.226914D+01  0.776120D+01  0.327796D+01 -0.108886D+01 -0.100734D+01
      4  -0.563039D+01 -0.132775D+02 -0.998219D+01  0.822778D+01  0.555056D+01
      5   0.339542D+01  0.159476D+02  0.609493D+01 -0.710929D+01  0.822663D+01
      6   0.327966D+01  0.732457D+01  0.407652D+01 -0.357551D+01  0.243041D+01
               146           147           148           149           150 
      1   0.388800D+01  0.466614D+01  0.202050D+00 -0.115475D+01 -0.156247D+01
      2  -0.228738D+01 -0.485751D+01  0.164035D+01 -0.113478D+01  0.229538D+01
      3  -0.160063D+01  0.191373D+00 -0.184240D+01  0.228953D+01 -0.732917D+00
      4   0.261396D+01  0.226692D+01  0.400349D+01 -0.770497D+00  0.360740D+01
      5   0.694172D+00  0.943100D+01 -0.150746D+01  0.340668D+01 -0.259290D+01
      6   0.117699D+01  0.163704D+01  0.131899D+01  0.865930D+00  0.499892D+01
               151           152           153           154           155 
      1   0.836546D+01 -0.215283D+01 -0.141584D+01  0.767251D+00  0.351465D+00
      2  -0.118942D+02  0.156187D+01 -0.193319D+02 -0.145334D+01 -0.176859D+00
      3   0.352875D+01  0.590962D+00  0.207477D+02  0.686091D+00 -0.174606D+00
      4   0.506035D+01  0.785680D+01  0.720600D+01  0.380154D+01  0.768948D+01
      5   0.189793D+02  0.380702D+01  0.356437D+02 -0.235660D+01 -0.398208D+01
      6   0.671623D+01  0.468928D+01  0.157178D+02 -0.630876D+01 -0.232550D+01
               156           157           158           159           160 
      1  -0.336291D+00 -0.603360D+01 -0.251311D+02  0.120322D+02  0.543927D+01
      2  -0.334600D+00  0.709141D+01  0.287260D+02 -0.109683D+02 -0.377879D+01
      3   0.670891D+00 -0.105781D+01 -0.359494D+01 -0.106388D+01 -0.166048D+01
      4  -0.549360D+01  0.585005D+01  0.916229D+01 -0.451909D+01 -0.101225D+02
      5   0.683289D+01 -0.253618D+01 -0.522430D+01  0.468036D+01  0.778106D+01
      6   0.228849D+01 -0.498924D+01 -0.192202D+02  0.186120D+02  0.111424D+02
               161           162           163           164           165 
      1   0.247514D+02 -0.272664D+02 -0.243558D+00  0.442232D+01  0.228415D+01
      2  -0.194861D+02  0.135817D+02  0.227651D+01 -0.517050D+01 -0.189450D+01
      3  -0.526532D+01  0.136848D+02 -0.203295D+01  0.748175D+00 -0.389653D+00
      4  -0.103862D+02  0.815360D+01  0.126881D+01  0.792122D+01  0.365037D+01
      5   0.107901D+02 -0.121605D+02  0.106713D+01  0.184904D+01  0.260265D+01
      6   0.354286D+02 -0.362303D+02  0.451697D+01 -0.144324D+01 -0.808306D+00
               166           167           168           169           170 
      1  -0.362804D+01 -0.374258D+02 -0.111119D+02  0.232228D+00 -0.203320D+02
      2   0.538138D+01  0.540488D+02  0.164959D+02  0.166286D+01  0.270073D+02
      3  -0.175334D+01 -0.166229D+02 -0.538402D+01 -0.189509D+01 -0.667535D+01
      4   0.677523D+01  0.108263D+02  0.321708D+01  0.520073D+01  0.576622D+01
      5   0.164524D+01  0.380081D+01  0.341707D+01  0.369382D+01  0.556519D+01
      6   0.219299D+01  0.223818D+02  0.161437D+02  0.467202D+01  0.265155D+02
               171           172           173           174           175 
      1  -0.164752D+02  0.394889D+01 -0.273826D+01  0.571854D+01  0.981061D+00
      2   0.154509D+02 -0.391752D+01  0.304669D+01 -0.886560D+00 -0.116797D+01
      3   0.102425D+01 -0.313727D-01 -0.308427D+00 -0.483198D+01  0.186911D+00
      4   0.448162D+01 -0.487475D+00 -0.208775D+01 -0.164574D+01 -0.426992D+00
      5   0.217317D+01  0.189884D+01  0.163663D+00 -0.839337D+00  0.886749D+00
      6   0.146387D+02 -0.149718D+01 -0.176060D+01  0.356992D+01 -0.805100D-01
               176           177           178           179           180 
      1  -0.579458D+01  0.217205D+01  0.659904D+01  0.377643D+01 -0.181611D+02
      2   0.440006D+01 -0.242194D+01 -0.394382D+01 -0.260598D+01 -0.935370D+01
      3   0.139453D+01  0.249890D+00 -0.265522D+01 -0.117045D+01  0.275148D+02
      4  -0.150038D+01  0.214630D+01 -0.717126D+01  0.782221D+01 -0.323933D+01
      5   0.173587D+01  0.113375D-01  0.779085D+01 -0.634220D+01  0.335128D+02
      6  -0.198134D+01  0.601843D+01 -0.209356D+01  0.918746D+01 -0.261094D+02
               181           182           183           184           185 
      1   0.895454D+02 -0.924637D+01 -0.345009D+01  0.654036D+01  0.376863D+01
      2  -0.460519D+02  0.130297D+01  0.146653D+01 -0.632732D+01  0.909472D+00
      3  -0.434934D+02  0.794340D+01  0.198356D+01 -0.213044D+00 -0.467810D+01
      4  -0.384712D+02  0.166045D+02  0.734140D+00  0.813061D+01 -0.368925D+01
      5   0.223165D+01 -0.560733D+00  0.105771D+02  0.533592D+00 -0.161480D+01
      6   0.183068D+01  0.976443D+00 -0.419075D+01  0.308128D+00  0.110714D+01
               186           187           188           189           190 
      1  -0.721252D+00 -0.817075D+01 -0.130132D+00  0.589388D+01  0.320322D+01
      2   0.122696D+01  0.446358D+01  0.190549D+01 -0.498898D+01  0.509152D+00
      3  -0.505705D+00  0.370717D+01 -0.177536D+01 -0.904897D+00 -0.371237D+01
      4  -0.171143D+01  0.451496D+01 -0.393873D+01 -0.307848D+01 -0.171128D+01
      5   0.984261D+00  0.117928D+02 -0.196757D+01 -0.489519D+00 -0.147031D+01
      6   0.767212D+00 -0.341565D+01  0.198962D+01 -0.691481D+00  0.200224D+01
               191           192           193           194           195 
      1  -0.833427D+01 -0.224014D+01 -0.559282D+01 -0.278624D+02 -0.602658D+01
      2   0.957598D+01  0.226026D+01  0.170974D+01  0.486588D+02  0.100495D+02
      3  -0.124171D+01 -0.201235D-01  0.388309D+01 -0.207963D+02 -0.402288D+01
      4  -0.576750D+00  0.124629D+01  0.901659D+01 -0.335101D+02 -0.614893D+01
      5  -0.433971D+00 -0.120327D+01 -0.747718D+00 -0.816937D+01 -0.688064D+01
      6   0.665823D+00  0.254316D+01 -0.174267D+00  0.750249D+01  0.879191D+01
               196           197           198 
      1  -0.430892D+01 -0.688475D+01 -0.749688D+01
      2   0.134758D+01  0.118576D+02  0.614355D+01
      3   0.296134D+01 -0.497289D+01  0.135333D+01
      4   0.519459D+01 -0.113130D+02 -0.462099D+01
      5   0.105557D+01 -0.625781D+01 -0.210948D+01
      6  -0.264614D-01  0.948956D+01  0.455946D+01
 End of Minotr F.D. properties file   788 does not exist.
 Leave Link 1002 at Thu Jul  8 18:49:03 2021, MaxMem= 10737418240 cpu:           20041.9 elap:            1254.1
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l601.exe)
 Copying SCF densities to generalized density rwf, IOpCl= 0 IROHF=0.

 **********************************************************************

            Population analysis using the SCF density.

 **********************************************************************

 Orbital symmetries:
       Occupied  (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
       Virtual   (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A)
 The electronic state is 1-A.
 Alpha  occ. eigenvalues --  -10.19011 -10.18485 -10.18420 -10.18413 -10.18381
 Alpha  occ. eigenvalues --  -10.18337 -10.18326 -10.18249 -10.18045 -10.17526
 Alpha  occ. eigenvalues --   -0.87671  -0.81810  -0.76785  -0.73113  -0.71476
 Alpha  occ. eigenvalues --   -0.65262  -0.61192  -0.57830  -0.56510  -0.50740
 Alpha  occ. eigenvalues --   -0.47281  -0.46332  -0.44628  -0.42919  -0.42674
 Alpha  occ. eigenvalues --   -0.40775  -0.38808  -0.37536  -0.37130  -0.35248
 Alpha  occ. eigenvalues --   -0.34047  -0.33274  -0.32729  -0.32254  -0.25105
 Alpha  occ. eigenvalues --   -0.23842
 Alpha virt. eigenvalues --   -0.01819  -0.00822  -0.00454   0.00183   0.00266
 Alpha virt. eigenvalues --    0.01335   0.02009   0.02142   0.03070   0.03467
 Alpha virt. eigenvalues --    0.04375   0.04665   0.05013   0.06725   0.06943
 Alpha virt. eigenvalues --    0.07427   0.08306   0.08501   0.08606   0.08932
 Alpha virt. eigenvalues --    0.09042   0.09644   0.09954   0.10175   0.10547
 Alpha virt. eigenvalues --    0.10897   0.11504   0.11656   0.11961   0.12406
 Alpha virt. eigenvalues --    0.12795   0.12929   0.13722   0.13812   0.14450
 Alpha virt. eigenvalues --    0.14651   0.15156   0.15352   0.15685   0.15820
 Alpha virt. eigenvalues --    0.16448   0.17599   0.17720   0.19038   0.19393
 Alpha virt. eigenvalues --    0.19552   0.20542   0.21164   0.21717   0.21888
 Alpha virt. eigenvalues --    0.22153   0.22886   0.23142   0.23443   0.24267
 Alpha virt. eigenvalues --    0.24509   0.24894   0.25262   0.25541   0.25957
 Alpha virt. eigenvalues --    0.27394   0.27517   0.28269   0.28505   0.29450
 Alpha virt. eigenvalues --    0.29763   0.30222   0.30699   0.31385   0.32043
 Alpha virt. eigenvalues --    0.32497   0.33079   0.33561   0.34005   0.34456
 Alpha virt. eigenvalues --    0.35036   0.36580   0.36593   0.37546   0.37902
 Alpha virt. eigenvalues --    0.38497   0.38870   0.39108   0.40095   0.40607
 Alpha virt. eigenvalues --    0.41017   0.41306   0.42744   0.42769   0.44063
 Alpha virt. eigenvalues --    0.44449   0.45153   0.45240   0.45770   0.46915
 Alpha virt. eigenvalues --    0.47466   0.47588   0.48480   0.49439   0.50404
 Alpha virt. eigenvalues --    0.51032   0.51938   0.52867   0.53107   0.53725
 Alpha virt. eigenvalues --    0.54306   0.54689   0.54974   0.55709   0.56253
 Alpha virt. eigenvalues --    0.56510   0.56896   0.57452   0.57820   0.58158
 Alpha virt. eigenvalues --    0.58551   0.58962   0.59881   0.61002   0.61731
 Alpha virt. eigenvalues --    0.62742   0.63427   0.64196   0.64283   0.65249
 Alpha virt. eigenvalues --    0.65280   0.65772   0.66465   0.67114   0.67624
 Alpha virt. eigenvalues --    0.68996   0.69501   0.69619   0.70280   0.70978
 Alpha virt. eigenvalues --    0.72036   0.72827   0.74136   0.74692   0.74957
 Alpha virt. eigenvalues --    0.75740   0.76892   0.77377   0.77702   0.78446
 Alpha virt. eigenvalues --    0.78631   0.79012   0.79158   0.80627   0.81094
 Alpha virt. eigenvalues --    0.82300   0.83123   0.83719   0.86123   0.86885
 Alpha virt. eigenvalues --    0.87701   0.88767   0.89611   0.90771   0.92578
 Alpha virt. eigenvalues --    0.94574   0.95143   0.95914   0.97187   0.98835
 Alpha virt. eigenvalues --    1.00466   1.01193   1.02246   1.02956   1.03934
 Alpha virt. eigenvalues --    1.04642   1.06917   1.08587   1.10088   1.11658
 Alpha virt. eigenvalues --    1.12881   1.14933   1.15272   1.19860   1.20954
 Alpha virt. eigenvalues --    1.22244   1.25376   1.28888   1.30914   1.31712
 Alpha virt. eigenvalues --    1.32840   1.33355   1.34475   1.36913   1.37501
 Alpha virt. eigenvalues --    1.38537   1.38728   1.40363   1.41495   1.42786
 Alpha virt. eigenvalues --    1.43575   1.43886   1.46376   1.48144   1.49720
 Alpha virt. eigenvalues --    1.50966   1.52279   1.53560   1.54280   1.56287
 Alpha virt. eigenvalues --    1.57168   1.58770   1.59204   1.60587   1.60982
 Alpha virt. eigenvalues --    1.62721   1.63637   1.65079   1.66713   1.67463
 Alpha virt. eigenvalues --    1.68379   1.69157   1.69783   1.70579   1.73411
 Alpha virt. eigenvalues --    1.74019   1.75195   1.75971   1.76838   1.78697
 Alpha virt. eigenvalues --    1.79129   1.80224   1.81943   1.83992   1.84799
 Alpha virt. eigenvalues --    1.85277   1.86083   1.87375   1.88681   1.89928
 Alpha virt. eigenvalues --    1.92316   1.92989   1.95182   1.96019   1.97313
 Alpha virt. eigenvalues --    1.98595   1.99088   2.00119   2.01076   2.02349
 Alpha virt. eigenvalues --    2.04124   2.05785   2.07118   2.07394   2.08438
 Alpha virt. eigenvalues --    2.10428   2.12066   2.13257   2.14610   2.15709
 Alpha virt. eigenvalues --    2.18482   2.20037   2.21336   2.21654   2.22265
 Alpha virt. eigenvalues --    2.23539   2.24938   2.27332   2.30211   2.32574
 Alpha virt. eigenvalues --    2.33995   2.35641   2.37969   2.39142   2.42847
 Alpha virt. eigenvalues --    2.44614   2.47423   2.50513   2.51210   2.52336
 Alpha virt. eigenvalues --    2.54062   2.57054   2.57645   2.60284   2.63230
 Alpha virt. eigenvalues --    2.65333   2.65824   2.70501   2.72652   2.74192
 Alpha virt. eigenvalues --    2.78118   2.80871   2.82792   2.83915   2.84809
 Alpha virt. eigenvalues --    2.88248   2.95358   2.99016   3.04055   3.07101
 Alpha virt. eigenvalues --    3.12565   3.41677   3.50747   3.58113   3.74917
 Alpha virt. eigenvalues --    3.93224   4.64919
          Condensed to atoms (all electrons):
               1          2          3          4          5          6
     1  C   16.733004  -7.468907   7.265939  -5.987499   5.405941  -9.600983
     2  C   -7.468907  15.506895  -7.994506   4.739284  -5.941755   7.357666
     3  C    7.265939  -7.994506  26.427771 -11.740552   6.224638  -9.818464
     4  C   -5.987499   4.739284 -11.740552  30.400102 -15.236342   6.872915
     5  C    5.405941  -5.941755   6.224638 -15.236342  31.712026 -14.097736
     6  C   -9.600983   7.357666  -9.818464   6.872915 -14.097736  29.452490
     7  C    0.108646  -0.043183   0.078390  -6.450015   0.479095  -3.359053
     8  C    0.122421  -0.144665  -0.223306  -0.525709  -0.574654  -0.491062
     9  C   -0.297208   0.363491  -3.578204   2.735351  -4.686201   1.000000
    10  H   -2.237469   1.035224  -0.287403   0.013151  -0.167187   0.960152
    11  H    1.138645  -2.204413   0.924592  -0.227318  -0.007989  -0.294956
    12  H   -0.507133   0.865218  -2.995301   1.675758  -0.307908   0.337036
    13  H    1.035367  -0.423666   0.314562  -0.634459   1.742862  -3.524094
    14  H    0.003991  -0.000185   0.042328   0.419540   0.551734   0.338861
    15  C    0.015266  -0.028743   0.016350   0.094280  -0.488778  -0.454403
    16  H    0.001903   0.003492   0.069812   0.073254   0.035620  -0.143056
    17  H    0.024566  -0.025672   0.041583  -0.133541   0.338837   0.121396
    18  H   -0.026108   0.009639  -0.014366   0.117529   0.139670   0.143758
    19  H    0.047655  -0.142386   0.198722   0.189503   0.407486  -0.103879
    20  H    0.007980   0.011880  -0.014486   0.119236  -0.427933   0.151476
    21  H   -0.006361   0.001170  -0.004511  -0.061735   0.487595  -0.094417
    22  H    0.037076  -0.010274  -0.003112  -0.035521  -0.179654   0.012730
               7          8          9         10         11         12
     1  C    0.108646   0.122421  -0.297208  -2.237469   1.138645  -0.507133
     2  C   -0.043183  -0.144665   0.363491   1.035224  -2.204413   0.865218
     3  C    0.078390  -0.223306  -3.578204  -0.287403   0.924592  -2.995301
     4  C   -6.450015  -0.525709   2.735351   0.013151  -0.227318   1.675758
     5  C    0.479095  -0.574654  -4.686201  -0.167187  -0.007989  -0.307908
     6  C   -3.359053  -0.491062   1.000000   0.960152  -0.294956   0.337036
     7  C   16.902929   0.055564  -0.972872   0.067820  -0.028711  -0.010377
     8  C    0.055564   7.293550   0.003357  -0.002055   0.004867   0.006273
     9  C   -0.972872   0.003357  11.807516  -0.034052   0.059366   0.123047
    10  H    0.067820  -0.002055  -0.034052   2.874353  -0.176245  -0.033777
    11  H   -0.028711   0.004867   0.059366  -0.176245   2.850363  -0.197174
    12  H   -0.010377   0.006273   0.123047  -0.033777  -0.197174   2.919302
    13  H    0.023848   0.126933  -0.064282  -0.206053  -0.035963   0.025380
    14  H   -1.652962   0.131205  -0.184523  -0.002305   0.001045  -0.002724
    15  C    0.713030  -0.094301  -0.006469   0.011260  -0.000554   0.003205
    16  H    0.441517  -0.928628   0.294388   0.000335   0.000348   0.001590
    17  H   -0.477897  -0.204151  -0.053027   0.000716  -0.000380   0.004398
    18  H   -0.224521   0.007728  -0.161633  -0.000077  -0.000556   0.009554
    19  H    0.201365   0.150901  -1.111491   0.000631  -0.001358  -0.026348
    20  H    0.056809  -0.103605  -0.052302  -0.000524   0.000692  -0.000017
    21  H   -0.381975   0.181393   0.023393   0.001077  -0.000106   0.000367
    22  H    0.580452  -0.195144   0.032207   0.000575  -0.000085  -0.000550
              13         14         15         16         17         18
     1  C    1.035367   0.003991   0.015266   0.001903   0.024566  -0.026108
     2  C   -0.423666  -0.000185  -0.028743   0.003492  -0.025672   0.009639
     3  C    0.314562   0.042328   0.016350   0.069812   0.041583  -0.014366
     4  C   -0.634459   0.419540   0.094280   0.073254  -0.133541   0.117529
     5  C    1.742862   0.551734  -0.488778   0.035620   0.338837   0.139670
     6  C   -3.524094   0.338861  -0.454403  -0.143056   0.121396   0.143758
     7  C    0.023848  -1.652962   0.713030   0.441517  -0.477897  -0.224521
     8  C    0.126933   0.131205  -0.094301  -0.928628  -0.204151   0.007728
     9  C   -0.064282  -0.184523  -0.006469   0.294388  -0.053027  -0.161633
    10  H   -0.206053  -0.002305   0.011260   0.000335   0.000716  -0.000077
    11  H   -0.035963   0.001045  -0.000554   0.000348  -0.000380  -0.000556
    12  H    0.025380  -0.002724   0.003205   0.001590   0.004398   0.009554
    13  H    3.526227   0.031888   0.135452  -0.002333   0.004581  -0.001628
    14  H    0.031888   2.180958  -0.289198  -0.248980   0.119695   0.068428
    15  C    0.135452  -0.289198   4.910276   0.076704  -0.131705   0.016478
    16  H   -0.002333  -0.248980   0.076704   2.445752  -0.417823  -0.258635
    17  H    0.004581   0.119695  -0.131705  -0.417823   2.403548   0.164747
    18  H   -0.001628   0.068428   0.016478  -0.258635   0.164747   1.671807
    19  H   -0.005341   0.002931  -0.015503   0.034758  -0.244292  -0.427474
    20  H   -0.022885   0.078710   0.352000  -0.002442  -0.034457  -0.001583
    21  H    0.019190  -0.018351  -0.017177  -0.013672  -0.003147   0.002812
    22  H   -0.088350  -0.120369   0.018963   0.012160   0.003584   0.000266
              19         20         21         22
     1  C    0.047655   0.007980  -0.006361   0.037076
     2  C   -0.142386   0.011880   0.001170  -0.010274
     3  C    0.198722  -0.014486  -0.004511  -0.003112
     4  C    0.189503   0.119236  -0.061735  -0.035521
     5  C    0.407486  -0.427933   0.487595  -0.179654
     6  C   -0.103879   0.151476  -0.094417   0.012730
     7  C    0.201365   0.056809  -0.381975   0.580452
     8  C    0.150901  -0.103605   0.181393  -0.195144
     9  C   -1.111491  -0.052302   0.023393   0.032207
    10  H    0.000631  -0.000524   0.001077   0.000575
    11  H   -0.001358   0.000692  -0.000106  -0.000085
    12  H   -0.026348  -0.000017   0.000367  -0.000550
    13  H   -0.005341  -0.022885   0.019190  -0.088350
    14  H    0.002931   0.078710  -0.018351  -0.120369
    15  C   -0.015503   0.352000  -0.017177   0.018963
    16  H    0.034758  -0.002442  -0.013672   0.012160
    17  H   -0.244292  -0.034457  -0.003147   0.003584
    18  H   -0.427474  -0.001583   0.002812   0.000266
    19  H    2.197830   0.001179   0.000830  -0.001948
    20  H    0.001179   1.939748  -0.437049  -0.374346
    21  H    0.000830  -0.437049   2.139791  -0.511418
    22  H   -0.001948  -0.374346  -0.511418   2.171871
 Mulliken charges:
               1
     1  C    0.183268
     2  C    0.534398
     3  C    1.069524
     4  C   -0.417214
     5  C    0.590637
     6  C    1.233624
     7  C   -0.107898
     8  C    1.403088
     9  C    0.760150
    10  H   -0.818147
    11  H   -0.804110
    12  H   -0.889815
    13  H   -0.977235
    14  H   -0.451718
    15  C    1.163570
    16  H   -0.476063
    17  H   -0.501558
    18  H   -0.235835
    19  H   -0.353772
    20  H   -0.248083
    21  H   -0.307700
    22  H   -0.349112
 Sum of Mulliken charges =  -0.00000
 Mulliken charges with hydrogens summed into heavy atoms:
               1
     1  C   -0.634879
     2  C   -0.269712
     3  C    0.179709
     4  C   -0.417214
     5  C    0.590637
     6  C    0.256390
     7  C   -0.559616
     8  C    0.425467
     9  C    0.170543
    15  C    0.258675
 Electronic spatial extent (au):  <R**2>=           1424.1872
 Charge=             -0.0000 electrons
 Dipole moment (field-independent basis, Debye):
    X=              0.6331    Y=              0.2294    Z=             -0.1271  Tot=              0.6852
 Quadrupole moment (field-independent basis, Debye-Ang):
   XX=            -58.9492   YY=            -58.3048   ZZ=            -63.8049
   XY=              0.1341   XZ=             -1.0418   YZ=              0.5750
 Traceless Quadrupole moment (field-independent basis, Debye-Ang):
   XX=              1.4037   YY=              2.0482   ZZ=             -3.4519
   XY=              0.1341   XZ=             -1.0418   YZ=              0.5750
 Octapole moment (field-independent basis, Debye-Ang**2):
  XXX=             -6.9791  YYY=             -0.6926  ZZZ=             -0.4399  XYY=             -3.8186
  XXY=              0.5359  XXZ=              0.7261  XZZ=              7.2216  YZZ=              2.2317
  YYZ=             -0.6324  XYZ=             -0.5249
 Hexadecapole moment (field-independent basis, Debye-Ang**3):
 XXXX=          -1189.1439 YYYY=           -652.8602 ZZZZ=           -120.6481 XXXY=              4.9214
 XXXZ=            -14.9702 YYYX=              2.8335 YYYZ=              7.5536 ZZZX=              0.5240
 ZZZY=             -1.4788 XXYY=           -311.5155 XXZZ=           -239.8378 YYZZ=           -135.8725
 XXYZ=              1.3260 YYXZ=             -3.2496 ZZXY=             -0.0694
 N-N= 5.041436815771D+02 E-N=-1.907650553711D+03  KE= 3.860474937157D+02
 No NMR shielding tensors so no spin-rotation constants.
 Leave Link  601 at Thu Jul  8 18:49:04 2021, MaxMem= 10737418240 cpu:               6.2 elap:               0.6
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l716.exe)
 Electric field and nuclear coordinate derivatives read from checkpoint file.
 Rotating derivatives to standard orientation.
 Dipole        = 2.28478003D-01 8.49444388D-02-4.65017555D-02
 Polarizability= 1.37957720D+02 1.63918920D+00 1.21489626D+02
                -3.54523752D+00 1.51232014D+00 7.49665008D+01
 Translational dAlpha, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1     -0.0000    0.0000       -0.0000    0.0000       -0.0000    0.0000
 2     -0.0000    0.0000        0.0000    0.0000       -0.0000    0.0000
 3     -0.0000    0.0000        0.0000    0.0000       -0.0000    0.0000
 4      0.0000    0.0000       -0.0000    0.0000        0.0000    0.0000
 5      0.0000    0.0000       -0.0000    0.0000        0.0000    0.0000
 6     -0.0000    0.0000       -0.0000    0.0000       -0.0000    0.0000
 Translational dG, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1     -0.0000    0.0000        1.8746    1.8746        1.0226    1.0207
 2     -1.8746   -1.8746       -0.6987   -0.6996       -9.7146   -9.7152
 3     -1.0226   -1.0207       34.2168   34.2183        0.6979    0.6996
 4      0.6987    0.6996       -0.0000    0.0000       -1.0229   -1.0207
 5    -24.5022  -24.5031        1.0229    1.0207        1.8803    1.8746
 6     -0.6979   -0.6996       -1.8803   -1.8746       -0.0000    0.0000
 Translational dA, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1     -0.0000    0.0000       -5.6237   -5.6237        3.0621    3.0621
 2      2.0988    2.0988       -0.0000    0.0000        3.0621    3.0621
 3      2.0988    2.0988       -5.6237   -5.6237       -0.0000    0.0000
 4     -5.6237   -5.6237       -2.0988   -2.0988      -29.1455  -29.1455
 5     -3.0621   -3.0621      102.6549  102.6549        2.0988    2.0988
 6    -73.5094  -73.5094        3.0621    3.0621        5.6237    5.6237
 Rotational dAlpha, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0088    0.0000       -7.5047   -7.4983       -4.0763   -4.0828
 2      7.4528    7.4983        2.7444    2.7984       38.7989   38.8606
 3      4.0099    4.0828     -136.7615 -136.8732       -2.7697   -2.7984
 4     -2.7877   -2.7984        0.0280    0.0000        4.0623    4.0828
 5     98.0572   98.0125       -4.1618   -4.0828       -7.2604   -7.4983
 6      2.8651    2.7984        7.9949    7.4983        0.1031    0.0000
 Rotational dG, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1     -0.1360    0.0000        3.0833    3.1047      -12.1531  -12.1030
 2     -2.8639   -3.1047       46.7432   46.9869       13.7136   13.6894
 3     11.9870   12.1030       10.0839    9.9681      -47.7300  -46.9869
 4    -46.9911  -46.9869        0.1012    0.0000       11.7363   12.1030
 5    -23.7562  -23.6574      -12.7226  -12.1030        2.3949    3.1047
 6     47.3073   46.9869       -3.1680   -3.1047        0.7286    0.0000
 Rotational dA, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      4.7132    4.5628       29.8222   29.7206       16.2359   16.1970
 2    -66.0689  -66.0793       31.3050   31.0634       15.7560   16.1970
 3    -66.0153  -66.0793       29.7754   29.7206       28.6173   28.9454
 4     -1.2755   -1.3428       70.4925   70.6421       -0.3342   -0.1269
 5     12.7496   12.7485       20.1802   20.1399      -70.8160  -70.6421
 6    -20.0681  -20.0130      -13.7474  -12.7485        0.5443    1.3428
 Full mass-weighted force constant matrix:
 Low frequencies ---   -3.1738   -0.0008   -0.0005    0.0003    3.5765    6.0893
 Low frequencies ---  106.3497  149.1017  211.4380
 Diagonal vibrational polarizability:
        1.3206233       0.8750057       6.3154137
 Harmonic frequencies (cm**-1), IR intensities (KM/Mole), Raman scattering
 activities (A**4/AMU), depolarization ratios for plane and unpolarized
 incident light, reduced masses (AMU), force constants (mDyne/A),
 Raman invariants Alpha2 = alpha**2, Beta2 = beta(alpha)**2 (A**4/AMU)
 ROA invariants AlphaG = alphaG', Gamma2 = beta(G')**2, Delta2 = beta(A)**2, (10**4 A**5/AMU)
 Far-From-Resonance Raman intensities (K), ROA intensites (10**4 K), CID=(ROA/Raman)*10**4
    Raman1;ROA1;CID1 =ICPu/SCPu(180), Raman2;ROA2;CID2 =ICPd/SCPd(90)
    Raman3;ROA3;CID3 =DCPI(180) RC180 = degree of circularity
 and normal coordinates:
 Incident light (cm**-1):   18796.99
                      1                      2                      3
                      A                      A                      A
 Frequencies --    106.3496               149.1015               211.4379
 Red. masses --      2.7186                 2.4375                 2.3431
 Frc consts  --      0.0181                 0.0319                 0.0617
 IR Inten    --      0.0226                 0.9817                 0.9824
 RamAct Fr= 1--      1.6751                 3.0863                 1.4669
  Dep-P Fr= 1--      0.7266                 0.7450                 0.5522
  Dep-U Fr= 1--      0.8417                 0.8539                 0.7115
 Alpha2 Fr= 1--      0.0007                 0.0003                 0.0055
 Beta2  Fr= 1--      0.2350                 0.4392                 0.1739
 AlphaG Fr= 1--     -0.0002                 0.0012                -0.0035
 Gamma2 Fr= 1--      0.0313                 0.4554                 1.3331
 Delta2 Fr= 1--     -0.0006                 0.3693                 0.2396
 Raman1 Fr= 1--       6.701                 12.345                  5.867
 ROA1   Fr= 1--       2.982                 55.530                135.642
 CID1   Fr= 1--       0.445                  4.498                 23.118
 Raman2 Fr= 1--       2.820                  5.271                  2.087
 ROA2   Fr= 1--       0.755                  7.974                 30.077
 CID2   Fr= 1--       0.268                  1.513                 14.409
 Raman3 Fr= 1--       5.640                 10.542                  4.175
 ROA3   Fr= 1--       2.982                 55.530                135.642
 CID3   Fr= 1--       0.529                  5.268                 32.491
 RC180  Fr= 1--       0.683                  0.708                  0.423
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00  -0.00  -0.10     0.04  -0.01   0.05     0.07  -0.04   0.12
     2   6     0.01  -0.02   0.07     0.04  -0.03   0.15     0.02  -0.04  -0.02
     3   6     0.02  -0.02   0.14     0.02  -0.01   0.04    -0.02  -0.01  -0.12
     4   6     0.01  -0.01   0.05     0.00   0.02  -0.12    -0.00   0.03  -0.07
     5   6     0.00  -0.00  -0.05     0.01   0.02  -0.15     0.01   0.04  -0.08
     6   6    -0.01   0.01  -0.16     0.03   0.01  -0.11     0.06   0.01   0.05
     7   6     0.00  -0.03  -0.02     0.02   0.03  -0.00    -0.00   0.01  -0.06
     8   6     0.04   0.02  -0.18    -0.05  -0.00   0.14     0.04   0.00  -0.06
     9   6    -0.01   0.00   0.01     0.01   0.01  -0.11     0.00   0.05   0.17
    10   1    -0.01   0.00  -0.19     0.06  -0.03   0.13     0.10  -0.07   0.26
    11   1     0.02  -0.02   0.14     0.06  -0.05   0.31     0.02  -0.06  -0.02
    12   1     0.03  -0.03   0.25     0.01  -0.02   0.11    -0.06  -0.02  -0.16
    13   1    -0.02   0.01  -0.27     0.03   0.02  -0.14     0.10   0.02   0.12
    14   1     0.06  -0.21  -0.00     0.17   0.10   0.02     0.04  -0.03  -0.05
    15   6    -0.07   0.05   0.21    -0.10  -0.03   0.04    -0.16  -0.04   0.01
    16   1    -0.05   0.01  -0.35     0.07  -0.00   0.37    -0.03   0.04  -0.17
    17   1     0.24   0.09  -0.21    -0.31  -0.05   0.19     0.21  -0.04  -0.09
    18   1    -0.13   0.07   0.03     0.15  -0.14  -0.18    -0.00   0.35   0.31
    19   1     0.06  -0.05   0.07    -0.06   0.11  -0.23    -0.00  -0.17   0.41
    20   1    -0.14   0.25   0.20    -0.35  -0.15  -0.01    -0.35  -0.07  -0.02
    21   1    -0.06  -0.00   0.26    -0.07   0.01   0.30    -0.13  -0.10   0.21
    22   1    -0.07  -0.01   0.36     0.01   0.01  -0.13    -0.14  -0.01  -0.08
                      4                      5                      6
                      A                      A                      A
 Frequencies --    238.2188               264.2644               397.4969
 Red. masses --      1.1483                 2.4856                 2.6060
 Frc consts  --      0.0384                 0.1023                 0.2426
 IR Inten    --      0.0084                 1.6566                 0.3911
 RamAct Fr= 1--      0.1050                 0.4477                 1.0956
  Dep-P Fr= 1--      0.5291                 0.7234                 0.1093
  Dep-U Fr= 1--      0.6920                 0.8395                 0.1971
 Alpha2 Fr= 1--      0.0004                 0.0002                 0.0187
 Beta2  Fr= 1--      0.0121                 0.0626                 0.0360
 AlphaG Fr= 1--      0.0018                -0.0023                 0.0097
 Gamma2 Fr= 1--      0.0347                -0.4932                -0.4856
 Delta2 Fr= 1--      0.0468                -0.0578                -0.1301
 Raman1 Fr= 1--       0.420                  1.791                  4.382
 ROA1   Fr= 1--       4.834                -49.191                -50.785
 CID1   Fr= 1--      11.507                -27.467                -11.589
 Raman2 Fr= 1--       0.145                  0.752                  0.432
 ROA2   Fr= 1--       0.459                -11.374                -10.615
 CID2   Fr= 1--       3.158                -15.129                -24.576
 Raman3 Fr= 1--       0.291                  1.504                  0.864
 ROA3   Fr= 1--       4.834                -49.191                -50.785
 CID3   Fr= 1--      16.628                -32.717                -58.790
 RC180  Fr= 1--       0.384                  0.679                 -0.606
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.03   0.02   0.00    -0.06   0.04   0.08    -0.01   0.00   0.02
     2   6    -0.01   0.03  -0.01    -0.02   0.05   0.07    -0.02  -0.01   0.13
     3   6     0.01   0.01   0.00     0.02   0.01  -0.09    -0.04   0.01  -0.14
     4   6     0.00  -0.02   0.01    -0.00  -0.05  -0.12    -0.02   0.01  -0.01
     5   6    -0.01  -0.03   0.00    -0.02  -0.06  -0.13     0.01   0.01   0.09
     6   6    -0.03  -0.01   0.01    -0.08  -0.02  -0.08    -0.03   0.03  -0.16
     7   6    -0.00  -0.02  -0.01     0.02  -0.04  -0.03     0.03  -0.01   0.17
     8   6    -0.00  -0.01  -0.03    -0.03  -0.05   0.05     0.04   0.09  -0.03
     9   6    -0.00  -0.02   0.02    -0.02  -0.03   0.10    -0.04   0.03  -0.00
    10   1    -0.05   0.03   0.01    -0.07   0.05   0.21     0.00  -0.01   0.04
    11   1    -0.01   0.05  -0.02     0.00   0.09   0.19    -0.00  -0.03   0.28
    12   1     0.03   0.02  -0.00     0.08   0.04  -0.09    -0.06   0.02  -0.31
    13   1    -0.05  -0.02   0.02    -0.14  -0.04  -0.08    -0.05   0.04  -0.35
    14   1    -0.00  -0.03  -0.01     0.09  -0.03  -0.02    -0.01  -0.02   0.17
    15   6     0.07   0.04   0.01     0.15   0.10   0.05     0.06  -0.14  -0.01
    16   1    -0.02  -0.02  -0.07    -0.02  -0.01   0.11    -0.08   0.06  -0.28
    17   1     0.04  -0.01  -0.04    -0.05  -0.14   0.05     0.27   0.30  -0.06
    18   1    -0.02   0.02   0.03     0.05   0.18   0.21    -0.07   0.05   0.01
    19   1     0.00  -0.04   0.04    -0.09  -0.19   0.27    -0.07   0.01   0.01
    20   1    -0.34  -0.27  -0.07     0.40   0.35   0.10     0.13  -0.39   0.01
    21   1     0.09   0.41   0.45     0.12   0.11  -0.21     0.06  -0.15  -0.07
    22   1     0.53   0.03  -0.33     0.10  -0.00   0.34     0.01  -0.04  -0.22
                      7                      8                      9
                      A                      A                      A
 Frequencies --    423.4984               458.9573               519.9511
 Red. masses --      2.8403                 2.9757                 3.9080
 Frc consts  --      0.3001                 0.3693                 0.6225
 IR Inten    --      1.2983                 4.9778                 1.0822
 RamAct Fr= 1--      0.2771                 1.6073                 7.3438
  Dep-P Fr= 1--      0.7480                 0.1190                 0.1901
  Dep-U Fr= 1--      0.8558                 0.2126                 0.3195
 Alpha2 Fr= 1--      0.0000                 0.0269                 0.1024
 Beta2  Fr= 1--      0.0395                 0.0570                 0.3911
 AlphaG Fr= 1--      0.0002                 0.0239                -0.0521
 Gamma2 Fr= 1--      0.5528                 0.1002                -1.8251
 Delta2 Fr= 1--      0.0696                 0.0596                -0.4318
 Raman1 Fr= 1--       1.108                  6.429                 29.375
 ROA1   Fr= 1--      55.296                 11.527               -189.024
 CID1   Fr= 1--      49.895                  1.793                 -6.435
 Raman2 Fr= 1--       0.474                  0.684                  4.693
 ROA2   Fr= 1--      12.711                  1.928                -40.348
 CID2   Fr= 1--      26.802                  2.821                 -8.597
 Raman3 Fr= 1--       0.949                  1.367                  9.386
 ROA3   Fr= 1--      55.296                 11.527               -189.024
 CID3   Fr= 1--      58.299                  8.432                -20.138
 RC180  Fr= 1--       0.712                 -0.575                 -0.361
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.03  -0.08   0.05     0.02   0.03   0.14     0.09   0.02  -0.15
     2   6    -0.00  -0.09   0.03     0.03   0.06  -0.04     0.22   0.04   0.14
     3   6    -0.09   0.01  -0.09     0.06   0.01  -0.10     0.11   0.09  -0.09
     4   6    -0.02   0.13   0.10     0.05  -0.12   0.23     0.03  -0.02  -0.09
     5   6    -0.07   0.10   0.08     0.04  -0.09   0.04    -0.03  -0.07   0.19
     6   6     0.02   0.06  -0.10    -0.02  -0.05  -0.12     0.07  -0.12   0.03
     7   6    -0.11  -0.04  -0.03     0.03   0.07  -0.09    -0.16  -0.02   0.02
     8   6     0.04  -0.15   0.00    -0.02   0.05   0.02    -0.14  -0.04  -0.02
     9   6     0.15   0.01  -0.00    -0.05  -0.07   0.01    -0.07   0.02   0.00
    10   1     0.08  -0.12   0.07    -0.02   0.06   0.22    -0.04   0.13  -0.34
    11   1    -0.01  -0.14   0.03     0.02   0.10  -0.18     0.23   0.01   0.28
    12   1    -0.25  -0.03  -0.26     0.12   0.07  -0.41     0.13   0.10  -0.16
    13   1     0.13   0.12  -0.29    -0.13  -0.06  -0.38     0.08  -0.10  -0.08
    14   1    -0.20  -0.07  -0.05     0.02   0.11  -0.09    -0.33  -0.04  -0.02
    15   6     0.01   0.08   0.01    -0.09   0.08  -0.02    -0.08   0.07  -0.03
    16   1     0.12  -0.25   0.07    -0.02   0.13   0.09    -0.08  -0.10   0.05
    17   1    -0.03  -0.24   0.01    -0.08  -0.02   0.02    -0.21  -0.08  -0.01
    18   1     0.19  -0.12  -0.06    -0.20  -0.31  -0.11    -0.05   0.25   0.12
    19   1     0.34   0.11  -0.09    -0.04   0.09  -0.17    -0.14  -0.16   0.20
    20   1     0.05   0.16   0.02    -0.22   0.18  -0.04    -0.06   0.07  -0.03
    21   1    -0.01   0.29  -0.02    -0.06  -0.06   0.11    -0.09   0.17  -0.05
    22   1     0.20  -0.02   0.12    -0.17   0.08   0.03    -0.00   0.04  -0.01
                     10                     11                     12
                      A                      A                      A
 Frequencies --    534.3372               593.4048               621.4727
 Red. masses --      4.2641                 3.1132                 3.2123
 Frc consts  --      0.7173                 0.6459                 0.7310
 IR Inten    --      0.5710                 1.4833                 0.8010
 RamAct Fr= 1--      4.7604                 0.9364                 2.1411
  Dep-P Fr= 1--      0.7403                 0.5658                 0.3031
  Dep-U Fr= 1--      0.8508                 0.7227                 0.4652
 Alpha2 Fr= 1--      0.0008                 0.0033                 0.0218
 Beta2  Fr= 1--      0.6750                 0.1128                 0.1660
 AlphaG Fr= 1--      0.0026                 0.0172                -0.0043
 Gamma2 Fr= 1--      0.7036                 0.3071                 0.3648
 Delta2 Fr= 1--      0.2673                 0.1902                -0.2300
 Raman1 Fr= 1--      19.042                  3.746                  8.564
 ROA1   Fr= 1--      76.095                 35.566                 27.666
 CID1   Fr= 1--       3.996                  9.495                  3.230
 Raman2 Fr= 1--       8.100                  1.354                  1.992
 ROA2   Fr= 1--      14.747                  5.848                 10.596
 CID2   Fr= 1--       1.821                  4.320                  5.319
 Raman3 Fr= 1--      16.200                  2.707                  3.984
 ROA3   Fr= 1--      76.095                 35.566                 27.666
 CID3   Fr= 1--       4.697                 13.138                  6.944
 RC180  Fr= 1--       0.702                  0.445                 -0.070
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.19  -0.10  -0.07     0.03  -0.06   0.12    -0.12  -0.10   0.06
     2   6    -0.03  -0.06   0.07     0.14   0.01  -0.16     0.04  -0.05  -0.05
     3   6     0.07  -0.12  -0.05     0.08   0.06   0.09     0.13  -0.11   0.02
     4   6     0.09  -0.03  -0.09     0.02   0.03  -0.00     0.14   0.06   0.04
     5   6    -0.04  -0.06   0.05    -0.12  -0.02  -0.12     0.00   0.00   0.04
     6   6    -0.15  -0.07   0.05    -0.02  -0.11  -0.10    -0.11   0.03  -0.02
     7   6    -0.01   0.15   0.04    -0.16   0.00   0.17     0.00  -0.06  -0.04
     8   6     0.20   0.08   0.07    -0.02   0.03   0.02    -0.11   0.06  -0.05
     9   6     0.18   0.00   0.00     0.02   0.02   0.00     0.02   0.25  -0.04
    10   1    -0.23  -0.08  -0.14    -0.05   0.01   0.39    -0.14  -0.09   0.01
    11   1     0.01   0.10   0.19     0.13   0.03  -0.20     0.06   0.16  -0.17
    12   1     0.06  -0.13  -0.02     0.05   0.02   0.27     0.06  -0.13  -0.09
    13   1    -0.17  -0.08   0.08     0.07  -0.09   0.04    -0.07   0.06  -0.16
    14   1    -0.06   0.26   0.02    -0.06   0.03   0.18    -0.01  -0.14  -0.04
    15   6    -0.11   0.17  -0.06    -0.02   0.02  -0.01     0.04  -0.08   0.03
    16   1     0.14  -0.01  -0.12    -0.11  -0.14  -0.29     0.11  -0.00   0.31
    17   1     0.37   0.14   0.04     0.25   0.23  -0.02    -0.49  -0.04   0.01
    18   1     0.29  -0.03  -0.00     0.03  -0.08  -0.04    -0.10   0.45   0.05
    19   1     0.05   0.03  -0.04    -0.02   0.09  -0.08     0.08   0.08   0.16
    20   1    -0.16   0.15  -0.07     0.23  -0.17   0.04     0.02  -0.09   0.02
    21   1    -0.10   0.07  -0.01    -0.06   0.21  -0.24     0.05  -0.10   0.04
    22   1    -0.20   0.21  -0.09     0.07   0.03  -0.11     0.03  -0.08   0.02
                     13                     14                     15
                      A                      A                      A
 Frequencies --    732.6043               751.3681               767.8037
 Red. masses --      3.2203                 2.3853                 1.5851
 Frc consts  --      1.0183                 0.7934                 0.5506
 IR Inten    --      4.0162                18.1070                37.6064
 RamAct Fr= 1--      3.0946                18.3269                 8.3094
  Dep-P Fr= 1--      0.0960                 0.0640                 0.2359
  Dep-U Fr= 1--      0.1753                 0.1203                 0.3817
 Alpha2 Fr= 1--      0.0547                 0.3501                 0.1024
 Beta2  Fr= 1--      0.0904                 0.3674                 0.5287
 AlphaG Fr= 1--      0.0266                -0.0221                 0.0070
 Gamma2 Fr= 1--     -0.6940                -0.6713                -0.0259
 Delta2 Fr= 1--     -0.3086                -0.1176                 0.0254
 Raman1 Fr= 1--      12.378                 73.308                 33.238
 ROA1   Fr= 1--     -76.497                -68.207                 -1.678
 CID1   Fr= 1--      -6.180                 -0.930                 -0.050
 Raman2 Fr= 1--       1.085                  4.409                  6.344
 ROA2   Fr= 1--     -14.186                -15.170                 -0.825
 CID2   Fr= 1--     -13.078                 -3.441                 -0.130
 Raman3 Fr= 1--       2.169                  8.818                 12.688
 ROA3   Fr= 1--     -76.497                -68.207                 -1.678
 CID3   Fr= 1--     -35.261                 -7.735                 -0.132
 RC180  Fr= 1--      -0.649                 -0.759                 -0.237
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.06  -0.05  -0.16    -0.00   0.05  -0.05    -0.00  -0.01  -0.03
     2   6     0.10  -0.02   0.10    -0.05  -0.01  -0.04    -0.01   0.02  -0.09
     3   6    -0.00   0.07  -0.14     0.10  -0.15  -0.07    -0.06   0.07  -0.01
     4   6     0.02   0.05   0.20     0.08  -0.05   0.02    -0.03   0.01  -0.00
     5   6    -0.07   0.02  -0.19     0.07   0.05   0.01    -0.01  -0.04   0.11
     6   6    -0.03  -0.06   0.10     0.01   0.19  -0.03    -0.01  -0.09  -0.07
     7   6     0.00  -0.03  -0.05    -0.07  -0.03   0.05     0.05   0.02  -0.03
     8   6    -0.02   0.05   0.01    -0.06  -0.05  -0.00     0.03   0.02  -0.03
     9   6    -0.01   0.05   0.07    -0.05  -0.04   0.02     0.03   0.03  -0.02
    10   1    -0.11  -0.00   0.12     0.20  -0.11   0.43     0.00  -0.00   0.54
    11   1     0.14  -0.01   0.34     0.03   0.08   0.46     0.05  -0.10   0.52
    12   1    -0.08   0.03  -0.11     0.23  -0.15   0.25    -0.04   0.02   0.40
    13   1     0.07  -0.07   0.49     0.07   0.18   0.33    -0.01  -0.12   0.20
    14   1     0.16  -0.02  -0.02    -0.10  -0.04   0.04    -0.08  -0.01  -0.05
    15   6     0.04  -0.07   0.03    -0.05   0.04  -0.02     0.02  -0.01   0.00
    16   1    -0.09   0.11  -0.06    -0.11  -0.09  -0.11     0.12   0.05   0.17
    17   1     0.09   0.02  -0.01     0.04  -0.01  -0.02    -0.16  -0.06   0.01
    18   1    -0.11  -0.31  -0.11    -0.09  -0.15  -0.03    -0.02   0.11   0.02
    19   1     0.09   0.32  -0.21    -0.06   0.03  -0.06     0.08  -0.03   0.06
    20   1     0.06  -0.03   0.03     0.05  -0.01   0.00    -0.10   0.04  -0.02
    21   1     0.04  -0.03   0.01    -0.07   0.16  -0.11     0.05  -0.14   0.11
    22   1     0.09  -0.10   0.07     0.03   0.03  -0.04    -0.06   0.01   0.02
                     16                     17                     18
                      A                      A                      A
 Frequencies --    814.9262               857.7579               881.8694
 Red. masses --      2.1386                 2.8230                 1.3484
 Frc consts  --      0.8368                 1.2238                 0.6178
 IR Inten    --      0.4324                 0.1904                 0.0980
 RamAct Fr= 1--      2.0706                 9.1497                 1.1679
  Dep-P Fr= 1--      0.7358                 0.0864                 0.6424
  Dep-U Fr= 1--      0.8478                 0.1590                 0.7822
 Alpha2 Fr= 1--      0.0005                 0.1656                 0.0023
 Beta2  Fr= 1--      0.2926                 0.2425                 0.1523
 AlphaG Fr= 1--     -0.0003                 0.0764                 0.0052
 Gamma2 Fr= 1--      1.1583                 0.6199                -1.3048
 Delta2 Fr= 1--      1.3779                 0.5012                -0.8673
 Raman1 Fr= 1--       8.282                 36.599                  4.672
 ROA1   Fr= 1--     155.289                 75.547               -153.016
 CID1   Fr= 1--      18.750                  2.064                -32.755
 Raman2 Fr= 1--       3.511                  2.910                  1.827
 ROA2   Fr= 1--      16.776                 10.868                -24.377
 CID2   Fr= 1--       4.779                  3.735                -13.341
 Raman3 Fr= 1--       7.021                  5.820                  3.654
 ROA3   Fr= 1--     155.289                 75.547               -153.016
 CID3   Fr= 1--      22.116                 12.980                -41.872
 RC180  Fr= 1--       0.696                 -0.682                  0.564
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.05   0.08  -0.05     0.09   0.11   0.01     0.00  -0.01   0.06
     2   6    -0.11   0.02   0.06    -0.15   0.03   0.00    -0.01   0.00  -0.05
     3   6    -0.04  -0.03  -0.01    -0.02  -0.07  -0.02    -0.01   0.01  -0.10
     4   6     0.01  -0.06   0.10     0.02  -0.03  -0.02     0.00  -0.00   0.03
     5   6     0.02  -0.05  -0.11     0.04  -0.09   0.00     0.00   0.00  -0.04
     6   6     0.04  -0.07  -0.00     0.06  -0.10   0.00     0.01  -0.01   0.09
     7   6    -0.02   0.03   0.11    -0.11  -0.09  -0.07     0.01   0.02   0.03
     8   6    -0.00  -0.03  -0.07     0.02   0.07   0.08    -0.03  -0.01  -0.03
     9   6     0.08   0.06  -0.06     0.03   0.21   0.04     0.02  -0.01   0.01
    10   1     0.09   0.05   0.08     0.11   0.09  -0.08    -0.05   0.03  -0.39
    11   1    -0.14  -0.06  -0.06    -0.15  -0.09   0.10     0.04  -0.02   0.32
    12   1     0.02   0.02  -0.22     0.11  -0.03   0.13     0.06  -0.05   0.58
    13   1    -0.06  -0.14   0.24    -0.12  -0.15  -0.15    -0.06   0.03  -0.53
    14   1     0.11  -0.06   0.14    -0.16   0.01  -0.08     0.10  -0.03   0.04
    15   6    -0.04   0.07   0.01    -0.02  -0.06  -0.02    -0.00   0.02   0.01
    16   1     0.21  -0.25   0.16    -0.04  -0.05  -0.14     0.01  -0.03   0.02
    17   1    -0.31   0.05  -0.00     0.28   0.02   0.03    -0.08  -0.00  -0.02
    18   1    -0.14   0.32   0.06     0.22  -0.08  -0.09    -0.07  -0.03  -0.00
    19   1     0.28  -0.15   0.20    -0.11   0.42  -0.21     0.12   0.01   0.00
    20   1     0.13  -0.21   0.04    -0.01   0.19  -0.01     0.05  -0.11   0.02
    21   1    -0.07   0.08  -0.19    -0.04   0.19   0.01    -0.01  -0.01  -0.06
    22   1    -0.10   0.18  -0.22     0.23  -0.25   0.25    -0.06   0.08  -0.10
                     19                     20                     21
                      A                      A                      A
 Frequencies --    918.3026               935.9965               961.9110
 Red. masses --      1.9168                 1.3693                 1.2360
 Frc consts  --      0.9524                 0.7068                 0.6738
 IR Inten    --      0.1240                 0.5917                 0.0175
 RamAct Fr= 1--      1.7620                 0.4503                 0.0428
  Dep-P Fr= 1--      0.7211                 0.5375                 0.6272
  Dep-U Fr= 1--      0.8380                 0.6992                 0.7709
 Alpha2 Fr= 1--      0.0009                 0.0018                 0.0001
 Beta2  Fr= 1--      0.2461                 0.0525                 0.0055
 AlphaG Fr= 1--     -0.0036                 0.0051                -0.0042
 Gamma2 Fr= 1--      0.5376                 0.0546                 0.0427
 Delta2 Fr= 1--      0.0580                 0.0719                -0.0042
 Raman1 Fr= 1--       7.048                  1.801                  0.171
 ROA1   Fr= 1--      53.468                  7.548                  3.966
 CID1   Fr= 1--       7.586                  4.190                 23.166
 Raman2 Fr= 1--       2.953                  0.630                  0.066
 ROA2   Fr= 1--      12.439                  0.736                  1.058
 CID2   Fr= 1--       4.212                  1.168                 16.034
 Raman3 Fr= 1--       5.906                  1.259                  0.132
 ROA3   Fr= 1--      53.468                  7.548                  3.966
 CID3   Fr= 1--       9.053                  5.993                 30.051
 RC180  Fr= 1--       0.676                  0.398                  0.542
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.01  -0.01  -0.01     0.01  -0.00   0.06    -0.01   0.01  -0.09
     2   6     0.02   0.00  -0.01     0.01  -0.00   0.07     0.01  -0.01   0.09
     3   6    -0.00   0.01  -0.01    -0.01   0.00  -0.09    -0.01   0.00  -0.05
     4   6    -0.01  -0.04   0.03     0.00  -0.00  -0.00    -0.00   0.00  -0.01
     5   6    -0.04   0.04  -0.03    -0.00  -0.00   0.03     0.00  -0.00   0.01
     6   6    -0.00   0.03   0.03    -0.01   0.00  -0.11     0.01  -0.00   0.05
     7   6    -0.07  -0.04  -0.02    -0.01  -0.00  -0.00    -0.00   0.00   0.00
     8   6     0.20   0.11   0.02     0.02   0.02  -0.02    -0.00  -0.00   0.00
     9   6    -0.05  -0.06  -0.05     0.00  -0.00   0.02     0.00  -0.00  -0.01
    10   1     0.02  -0.02  -0.00    -0.03   0.03  -0.34     0.07  -0.04   0.59
    11   1     0.03  -0.01   0.08    -0.05   0.04  -0.42    -0.07   0.04  -0.57
    12   1     0.02   0.01   0.02     0.07  -0.05   0.52     0.04  -0.03   0.37
    13   1     0.05   0.07  -0.12     0.06  -0.05   0.56    -0.04   0.03  -0.39
    14   1    -0.11  -0.11  -0.02    -0.11  -0.08  -0.02    -0.01   0.03  -0.00
    15   6    -0.05  -0.05  -0.00    -0.00   0.00   0.00     0.00  -0.00  -0.00
    16   1     0.36   0.13   0.35     0.06   0.07   0.10    -0.01  -0.02  -0.02
    17   1    -0.19   0.05   0.09    -0.09  -0.07  -0.01     0.01   0.02   0.00
    18   1    -0.28   0.15   0.04    -0.06  -0.08  -0.01     0.01   0.02   0.00
    19   1    -0.25  -0.22   0.10     0.02   0.06  -0.04    -0.00  -0.02   0.01
    20   1     0.15   0.04   0.04     0.00  -0.02   0.00    -0.02   0.02  -0.01
    21   1    -0.10   0.34  -0.14    -0.00  -0.01   0.00     0.01  -0.01   0.02
    22   1     0.28  -0.22   0.15    -0.00   0.01  -0.01    -0.00  -0.01   0.01
                     22                     23                     24
                      A                      A                      A
 Frequencies --    969.7726               982.9209              1037.2100
 Red. masses --      1.3951                 2.1838                 2.2217
 Frc consts  --      0.7730                 1.2431                 1.4082
 IR Inten    --      0.6958                 0.7782                 0.6274
 RamAct Fr= 1--      0.1510                 3.7193                23.6947
  Dep-P Fr= 1--      0.5575                 0.3017                 0.1672
  Dep-U Fr= 1--      0.7159                 0.4636                 0.2865
 Alpha2 Fr= 1--      0.0006                 0.0380                 0.3506
 Beta2  Fr= 1--      0.0180                 0.2874                 1.1313
 AlphaG Fr= 1--     -0.0068                 0.0184                -0.0487
 Gamma2 Fr= 1--     -0.0591                -1.1770                 1.2204
 Delta2 Fr= 1--      0.2784                 0.2164                -0.5078
 Raman1 Fr= 1--       0.604                 14.877                 94.779
 ROA1   Fr= 1--       3.239               -106.069                100.910
 CID1   Fr= 1--       5.364                 -7.130                  1.065
 Raman2 Fr= 1--       0.216                  3.448                 13.576
 ROA2   Fr= 1--      -3.645                -29.979                 33.352
 CID2   Fr= 1--     -16.863                 -8.694                  2.457
 Raman3 Fr= 1--       0.432                  6.897                 27.152
 ROA3   Fr= 1--       3.239               -106.069                100.910
 CID3   Fr= 1--       7.493                -15.380                  3.717
 RC180  Fr= 1--       0.432                 -0.073                 -0.427
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00  -0.01   0.02     0.02   0.01   0.00     0.07   0.10  -0.00
     2   6     0.02  -0.00   0.00    -0.04  -0.00   0.00     0.02  -0.00  -0.01
     3   6    -0.00   0.01  -0.03     0.01  -0.02  -0.01     0.03  -0.12   0.00
     4   6     0.00  -0.00   0.06     0.02  -0.00   0.02    -0.02  -0.01  -0.03
     5   6    -0.00   0.00  -0.02    -0.03   0.01  -0.01    -0.12   0.04  -0.04
     6   6    -0.01   0.02  -0.01     0.01   0.01  -0.00    -0.01  -0.01   0.02
     7   6     0.01   0.02   0.03    -0.06   0.02  -0.01    -0.10   0.13   0.02
     8   6     0.02  -0.08   0.06    -0.14   0.15  -0.00     0.06  -0.00  -0.06
     9   6    -0.05   0.03  -0.09     0.17  -0.14  -0.02    -0.01  -0.02   0.05
    10   1    -0.02   0.00  -0.11     0.06  -0.02  -0.05     0.03   0.14   0.01
    11   1     0.02   0.00   0.01    -0.04  -0.02   0.02     0.04   0.00   0.02
    12   1     0.00  -0.01   0.14     0.04  -0.01   0.01    -0.01  -0.13  -0.10
    13   1     0.02   0.01   0.10     0.04   0.01   0.03    -0.06  -0.01  -0.09
    14   1     0.02   0.44   0.01    -0.13   0.22  -0.04    -0.45   0.17  -0.05
    15   6     0.03  -0.03  -0.06     0.02  -0.08  -0.01     0.14  -0.04   0.04
    16   1     0.02  -0.39  -0.19    -0.26   0.35  -0.05     0.21  -0.13   0.14
    17   1     0.13   0.26   0.06    -0.14   0.34   0.01    -0.13  -0.20  -0.04
    18   1    -0.18   0.28   0.02     0.22   0.09   0.09    -0.14  -0.15  -0.02
    19   1    -0.04  -0.17   0.13     0.39  -0.29   0.17    -0.04   0.08  -0.07
    20   1    -0.20   0.32  -0.09    -0.05   0.15  -0.02    -0.15  -0.06  -0.01
    21   1     0.06  -0.07   0.21     0.03   0.02   0.12     0.20  -0.46   0.29
    22   1     0.04  -0.14   0.23     0.14  -0.21   0.22    -0.18   0.05   0.03
                     25                     26                     27
                      A                      A                      A
 Frequencies --   1053.0252              1102.3884              1106.3668
 Red. masses --      2.0945                 1.6201                 2.0587
 Frc consts  --      1.3684                 1.1600                 1.4847
 IR Inten    --      3.8036                 2.6229                 2.2774
 RamAct Fr= 1--     32.6392                 0.9193                 1.5908
  Dep-P Fr= 1--      0.0372                 0.6855                 0.5420
  Dep-U Fr= 1--      0.0717                 0.8134                 0.7030
 Alpha2 Fr= 1--      0.6646                 0.0010                 0.0064
 Beta2  Fr= 1--      0.3902                 0.1246                 0.1864
 AlphaG Fr= 1--      0.0290                -0.0090                 0.0268
 Gamma2 Fr= 1--     -0.8083                 0.5288                 0.1460
 Delta2 Fr= 1--     -0.9465                 0.4874                 0.3546
 Raman1 Fr= 1--     130.557                  3.677                  6.363
 ROA1   Fr= 1--    -107.886                 66.362                 25.359
 CID1   Fr= 1--      -0.826                 18.048                  3.985
 Raman2 Fr= 1--       4.683                  1.495                  2.237
 ROA2   Fr= 1--     -11.828                  8.792                  0.666
 CID2   Fr= 1--      -2.526                  5.879                  0.298
 Raman3 Fr= 1--       9.366                  2.991                  4.473
 ROA3   Fr= 1--    -107.886                 66.362                 25.359
 CID3   Fr= 1--     -11.519                 22.188                  5.669
 RC180  Fr= 1--      -0.857                  0.627                  0.406
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.07   0.15   0.00    -0.03  -0.01   0.00     0.02  -0.05  -0.01
     2   6     0.17  -0.07  -0.02     0.02  -0.00  -0.00     0.01  -0.05  -0.01
     3   6    -0.07  -0.09  -0.00    -0.00   0.01   0.03    -0.02   0.13   0.01
     4   6    -0.02   0.00   0.01    -0.03   0.00  -0.09     0.02  -0.07  -0.00
     5   6     0.01  -0.03   0.01     0.06  -0.02  -0.01     0.02  -0.07  -0.05
     6   6    -0.12   0.06   0.01     0.00   0.00   0.01    -0.06   0.11   0.03
     7   6     0.03  -0.05  -0.01     0.04  -0.01   0.10    -0.05  -0.12   0.05
     8   6    -0.01   0.01   0.02     0.00  -0.01  -0.08    -0.00   0.08   0.01
     9   6     0.02   0.00  -0.02    -0.01   0.01   0.11     0.05   0.02   0.02
    10   1    -0.06   0.27   0.03    -0.06   0.02   0.03     0.29  -0.27  -0.06
    11   1     0.15  -0.28  -0.04     0.02   0.03  -0.02    -0.05  -0.39  -0.01
    12   1    -0.50  -0.26   0.06    -0.04   0.01  -0.09     0.17   0.21  -0.03
    13   1    -0.55  -0.10   0.07    -0.06  -0.02  -0.06    -0.19   0.08  -0.01
    14   1     0.14  -0.07   0.01     0.00   0.16   0.08    -0.26  -0.21   0.01
    15   6    -0.03   0.02  -0.01    -0.04  -0.03  -0.07     0.06   0.07  -0.05
    16   1    -0.06   0.07  -0.02     0.14  -0.08   0.12     0.10  -0.11   0.04
    17   1     0.04   0.08   0.02    -0.27   0.15  -0.02    -0.06   0.09   0.02
    18   1     0.07   0.07   0.01    -0.39  -0.29  -0.05    -0.01  -0.03  -0.00
    19   1     0.07  -0.03   0.03     0.46   0.25  -0.10    -0.15   0.04  -0.03
    20   1     0.02   0.02  -0.01    -0.08   0.30  -0.08    -0.27   0.11  -0.11
    21   1    -0.04   0.10  -0.06    -0.05   0.20   0.06     0.11  -0.27   0.17
    22   1     0.01   0.01  -0.03     0.13  -0.18   0.19    -0.25   0.16  -0.04
                     28                     29                     30
                      A                      A                      A
 Frequencies --   1130.4591              1182.3228              1184.7116
 Red. masses --      2.1900                 1.2158                 1.5869
 Frc consts  --      1.6489                 1.0013                 1.3123
 IR Inten    --      0.2800                 0.3149                 0.2666
 RamAct Fr= 1--      1.8501                 5.8670                 3.2621
  Dep-P Fr= 1--      0.6109                 0.2769                 0.5434
  Dep-U Fr= 1--      0.7585                 0.4338                 0.7042
 Alpha2 Fr= 1--      0.0047                 0.0644                 0.0129
 Beta2  Fr= 1--      0.2339                 0.4241                 0.3829
 AlphaG Fr= 1--      0.0355                -0.0380                 0.0064
 Gamma2 Fr= 1--      0.5395                 0.6121                -0.5298
 Delta2 Fr= 1--      0.1351                 0.3443                -0.2473
 Raman1 Fr= 1--       7.400                 23.468                 13.048
 ROA1   Fr= 1--      56.114                 69.779                -58.778
 CID1   Fr= 1--       7.583                  2.973                 -4.505
 Raman2 Fr= 1--       2.806                  5.090                  4.594
 ROA2   Fr= 1--      11.867                 11.936                -10.737
 CID2   Fr= 1--       4.228                  2.345                 -2.337
 Raman3 Fr= 1--       5.613                 10.179                  9.189
 ROA3   Fr= 1--      56.114                 69.779                -58.778
 CID3   Fr= 1--       9.997                  6.855                 -6.397
 RC180  Fr= 1--       0.517                 -0.132                  0.408
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.00  -0.04  -0.00     0.01  -0.05  -0.00     0.08  -0.01  -0.01
     2   6     0.04  -0.04  -0.01     0.02   0.07   0.00    -0.05   0.00   0.01
     3   6    -0.01   0.09   0.01    -0.06   0.00   0.01     0.05   0.01  -0.00
     4   6    -0.02  -0.10  -0.02     0.00  -0.02   0.01     0.06   0.10  -0.00
     5   6     0.06  -0.04   0.03     0.06  -0.01  -0.02    -0.08   0.03   0.01
     6   6    -0.07   0.08   0.00     0.01  -0.00   0.00    -0.07  -0.05   0.00
     7   6    -0.05   0.19  -0.08    -0.03   0.01   0.01     0.04   0.01   0.02
     8   6    -0.03  -0.01  -0.03    -0.02   0.03  -0.01     0.03  -0.06  -0.00
     9   6     0.03   0.03   0.02     0.02  -0.01   0.01    -0.06  -0.01  -0.01
    10   1     0.17  -0.18  -0.03     0.29  -0.28  -0.06     0.53  -0.38  -0.08
    11   1    -0.01  -0.28  -0.03     0.12   0.67   0.04    -0.05   0.01   0.00
    12   1     0.18   0.16   0.00    -0.47  -0.16   0.04     0.17   0.06  -0.01
    13   1    -0.29  -0.01   0.07    -0.16  -0.07   0.01    -0.51  -0.21   0.03
    14   1     0.11   0.38  -0.06    -0.10  -0.01  -0.00     0.08   0.03   0.03
    15   6    -0.02  -0.10   0.10     0.01  -0.01  -0.00    -0.01  -0.01  -0.01
    16   1     0.08  -0.33  -0.07     0.05  -0.13  -0.01    -0.12   0.33   0.04
    17   1     0.00  -0.17  -0.05    -0.03  -0.05  -0.02     0.03  -0.03   0.00
    18   1     0.05  -0.04  -0.01     0.10  -0.01   0.01    -0.12   0.01  -0.01
    19   1    -0.01   0.06  -0.03    -0.15  -0.01  -0.02     0.09  -0.02   0.01
    20   1     0.30  -0.23   0.16    -0.02   0.01  -0.01     0.02   0.05  -0.01
    21   1    -0.07   0.16  -0.14     0.01  -0.01   0.02    -0.02   0.07   0.00
    22   1     0.21  -0.13   0.01    -0.01  -0.01   0.02     0.03  -0.03   0.02
                     31                     32                     33
                      A                      A                      A
 Frequencies --   1194.1833              1217.7573              1242.5518
 Red. masses --      1.5167                 1.5827                 1.9720
 Frc consts  --      1.2743                 1.3828                 1.7939
 IR Inten    --      0.7081                 0.0174                 2.8113
 RamAct Fr= 1--      1.6200                14.0572                29.0391
  Dep-P Fr= 1--      0.5075                 0.1930                 0.0713
  Dep-U Fr= 1--      0.6733                 0.3236                 0.1330
 Alpha2 Fr= 1--      0.0077                 0.1945                 0.5452
 Beta2  Fr= 1--      0.1818                 0.7581                 0.6438
 AlphaG Fr= 1--     -0.0034                -0.0645                -0.0204
 Gamma2 Fr= 1--     -0.4039                 2.5190                -1.6913
 Delta2 Fr= 1--     -0.0601                 0.7055                -0.4409
 Raman1 Fr= 1--       6.480                 56.229                116.156
 ROA1   Fr= 1--     -40.701                264.401               -176.474
 CID1   Fr= 1--      -6.281                  4.702                 -1.519
 Raman2 Fr= 1--       2.182                  9.097                  7.726
 ROA2   Fr= 1--      -9.214                 54.812                -37.063
 CID2   Fr= 1--      -4.223                  6.025                 -4.797
 Raman3 Fr= 1--       4.363                 18.195                 15.452
 ROA3   Fr= 1--     -40.701                264.401               -176.474
 CID3   Fr= 1--      -9.328                 14.532                -11.421
 RC180  Fr= 1--       0.347                 -0.353                 -0.734
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.03  -0.01   0.01     0.01  -0.02  -0.00     0.08   0.00  -0.01
     2   6     0.01  -0.02  -0.00     0.06   0.02  -0.01     0.04   0.05  -0.00
     3   6    -0.01   0.02  -0.00    -0.02  -0.02   0.00    -0.03  -0.06  -0.01
     4   6     0.00  -0.02   0.05    -0.12  -0.11  -0.00    -0.07  -0.11   0.02
     5   6     0.06   0.00  -0.06    -0.01  -0.02  -0.01    -0.16   0.03   0.05
     6   6     0.01   0.00   0.01    -0.01   0.04   0.01    -0.07   0.02   0.00
     7   6     0.03   0.07   0.13    -0.01   0.00  -0.02     0.07  -0.02   0.03
     8   6    -0.00  -0.04  -0.07     0.04  -0.02   0.07    -0.02   0.02  -0.07
     9   6    -0.03   0.02  -0.03    -0.05   0.07  -0.05     0.04   0.04   0.03
    10   1    -0.14   0.08   0.01     0.08  -0.08  -0.01     0.18  -0.08  -0.02
    11   1    -0.00  -0.12   0.00     0.11   0.26   0.01     0.06   0.13   0.01
    12   1     0.03   0.03   0.02     0.24   0.07  -0.02     0.27   0.04  -0.01
    13   1    -0.08  -0.03  -0.02     0.06   0.07  -0.01     0.29   0.15   0.00
    14   1    -0.34  -0.07   0.06    -0.24  -0.12  -0.06     0.57  -0.03   0.14
    15   6    -0.02  -0.04  -0.05     0.01   0.01   0.02    -0.02  -0.00  -0.06
    16   1    -0.08   0.33   0.09    -0.12   0.29   0.01     0.11  -0.14   0.04
    17   1     0.03  -0.46  -0.09     0.19  -0.05   0.04    -0.11  -0.02  -0.05
    18   1     0.53   0.09   0.02     0.01   0.14  -0.01     0.41  -0.02   0.02
    19   1    -0.19  -0.03   0.00     0.73   0.06   0.06    -0.22   0.08  -0.05
    20   1    -0.04   0.20  -0.05     0.01  -0.07   0.02    -0.04   0.17  -0.06
    21   1    -0.02   0.13   0.09     0.01  -0.04  -0.01    -0.00   0.05   0.05
    22   1     0.07  -0.13   0.14    -0.03   0.04  -0.04     0.05  -0.07   0.07
                     34                     35                     36
                      A                      A                      A
 Frequencies --   1297.0190              1305.9485              1324.7066
 Red. masses --      1.3692                 1.6613                 1.3799
 Frc consts  --      1.3571                 1.6694                 1.4267
 IR Inten    --      1.3353                 0.3038                 1.5608
 RamAct Fr= 1--      4.3221                 5.6798                 3.8619
  Dep-P Fr= 1--      0.2212                 0.4121                 0.2809
  Dep-U Fr= 1--      0.3622                 0.5837                 0.4386
 Alpha2 Fr= 1--      0.0555                 0.0403                 0.0419
 Beta2  Fr= 1--      0.2609                 0.5525                 0.2823
 AlphaG Fr= 1--     -0.0650                 0.0214                 0.0357
 Gamma2 Fr= 1--      1.2082                 0.0040                -0.7210
 Delta2 Fr= 1--      0.7211                -0.6698                -0.5531
 Raman1 Fr= 1--      17.289                 22.719                 15.448
 ROA1   Fr= 1--     139.063                -21.046                -86.921
 CID1   Fr= 1--       8.044                 -0.926                 -5.627
 Raman2 Fr= 1--       3.131                  6.630                  3.388
 ROA2   Fr= 1--      23.228                  5.455                -12.880
 CID2   Fr= 1--       7.418                  0.823                 -3.802
 Raman3 Fr= 1--       6.263                 13.261                  6.775
 ROA3   Fr= 1--     139.063                -21.046                -86.921
 CID3   Fr= 1--      22.205                 -1.587                -12.830
 RC180  Fr= 1--      -0.276                  0.167                 -0.123
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.01  -0.01   0.00    -0.04   0.04   0.01     0.03  -0.03  -0.00
     2   6     0.01  -0.04  -0.00    -0.01  -0.04  -0.00     0.01   0.04   0.00
     3   6     0.02  -0.03  -0.01     0.05   0.03  -0.01    -0.04  -0.01   0.00
     4   6    -0.08   0.07   0.03    -0.02   0.04   0.02     0.03  -0.04   0.00
     5   6     0.04   0.06  -0.00     0.00  -0.11   0.01    -0.01   0.04  -0.02
     6   6     0.04  -0.02  -0.01     0.04   0.03  -0.01    -0.04  -0.01   0.01
     7   6    -0.00  -0.00  -0.03    -0.09  -0.07  -0.01     0.08  -0.01  -0.03
     8   6     0.01   0.05  -0.00     0.08  -0.02  -0.07     0.01  -0.10  -0.02
     9   6    -0.07  -0.05   0.02    -0.09  -0.00   0.02     0.01   0.03   0.04
    10   1    -0.11   0.06   0.01     0.11  -0.08  -0.02    -0.03   0.03   0.00
    11   1     0.04   0.15   0.01     0.01   0.05   0.00    -0.00  -0.05  -0.00
    12   1     0.37   0.10  -0.03    -0.15  -0.05   0.02     0.03   0.02  -0.01
    13   1    -0.41  -0.19   0.03     0.11   0.06   0.01     0.04   0.02  -0.01
    14   1    -0.03  -0.23  -0.02     0.28   0.61   0.03    -0.52   0.15  -0.15
    15   6     0.01  -0.00  -0.00     0.02   0.03   0.03    -0.02   0.01   0.04
    16   1     0.19  -0.42  -0.03     0.06   0.27   0.13    -0.06   0.13   0.02
    17   1    -0.12   0.25   0.03    -0.18   0.15  -0.01    -0.23   0.66   0.06
    18   1     0.45  -0.02   0.05     0.47   0.02   0.05     0.18  -0.05   0.00
    19   1     0.12  -0.03   0.01     0.12   0.06  -0.02    -0.21   0.07  -0.04
    20   1    -0.02   0.02  -0.01    -0.04  -0.11   0.02     0.09  -0.05   0.06
    21   1     0.01  -0.01   0.00     0.01  -0.07  -0.05    -0.04   0.04  -0.10
    22   1    -0.02   0.01  -0.01    -0.08   0.08  -0.05     0.04   0.06  -0.12
                     37                     38                     39
                      A                      A                      A
 Frequencies --   1335.0554              1358.9384              1367.5134
 Red. masses --      1.5676                 3.2740                 1.6180
 Frc consts  --      1.6462                 3.5623                 1.7827
 IR Inten    --      2.2313                 5.1057                 4.5271
 RamAct Fr= 1--      1.9070                15.3443                 9.7973
  Dep-P Fr= 1--      0.7143                 0.0903                 0.4919
  Dep-U Fr= 1--      0.8333                 0.1656                 0.6594
 Alpha2 Fr= 1--      0.0012                 0.2751                 0.0502
 Beta2  Fr= 1--      0.2649                 0.4235                 1.0767
 AlphaG Fr= 1--      0.0183                -0.0251                 0.0628
 Gamma2 Fr= 1--      0.7198                -0.4814                 1.4387
 Delta2 Fr= 1--      0.1157                -0.3210                 0.6235
 Raman1 Fr= 1--       7.628                 61.377                 39.189
 ROA1   Fr= 1--      72.805                -56.486                158.064
 CID1   Fr= 1--       9.544                 -0.920                  4.033
 Raman2 Fr= 1--       3.178                  5.082                 12.921
 ROA2   Fr= 1--      16.351                 -8.985                 29.540
 CID2   Fr= 1--       5.144                 -1.768                  2.286
 Raman3 Fr= 1--       6.357                 10.164                 25.842
 ROA3   Fr= 1--      72.805                -56.486                158.064
 CID3   Fr= 1--      11.453                 -5.557                  6.117
 RC180  Fr= 1--       0.667                 -0.669                  0.319
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.02  -0.06  -0.01     0.09  -0.12  -0.02     0.03  -0.01  -0.00
     2   6     0.02   0.01  -0.00    -0.01   0.17   0.01    -0.00   0.02   0.00
     3   6    -0.07  -0.03   0.01    -0.11  -0.02   0.01    -0.02  -0.02   0.00
     4   6    -0.05  -0.02  -0.00     0.21  -0.07  -0.03     0.01   0.02   0.00
     5   6     0.07   0.09   0.01     0.10   0.14   0.01    -0.02   0.04  -0.01
     6   6     0.02  -0.00  -0.00    -0.13  -0.06   0.01    -0.03  -0.02   0.00
     7   6    -0.09  -0.06   0.01    -0.13   0.00  -0.01     0.11  -0.14   0.02
     8   6     0.01  -0.04  -0.02     0.03   0.02   0.01    -0.04   0.11  -0.01
     9   6     0.09   0.02  -0.00    -0.15  -0.03   0.00    -0.02  -0.03  -0.01
    10   1    -0.26   0.17   0.04    -0.18   0.10   0.03    -0.01   0.02   0.00
    11   1     0.06   0.19   0.01    -0.12  -0.40  -0.02    -0.00  -0.00  -0.00
    12   1     0.36   0.13  -0.03    -0.18  -0.05   0.02     0.09   0.02  -0.01
    13   1    -0.36  -0.15   0.04     0.11   0.03  -0.00     0.01  -0.00  -0.01
    14   1     0.26   0.34   0.06     0.32  -0.04   0.08    -0.35   0.63  -0.11
    15   6     0.03   0.01   0.01     0.04   0.01  -0.02    -0.04   0.04   0.04
    16   1    -0.12   0.35   0.04     0.04  -0.04  -0.03     0.13  -0.26   0.00
    17   1    -0.01  -0.08  -0.02    -0.06  -0.03   0.02     0.16  -0.47  -0.08
    18   1    -0.26   0.02  -0.02     0.34  -0.04   0.01     0.00   0.04   0.02
    19   1    -0.28   0.00  -0.03     0.49   0.01   0.04     0.11  -0.01  -0.01
    20   1    -0.11  -0.03  -0.02    -0.10  -0.06  -0.04     0.07  -0.09   0.05
    21   1     0.02  -0.02  -0.02     0.06  -0.11   0.06    -0.06   0.00  -0.13
    22   1    -0.12   0.06  -0.00    -0.07  -0.01   0.09     0.06   0.06  -0.10
                     40                     41                     42
                      A                      A                      A
 Frequencies --   1413.0918              1483.8545              1491.6230
 Red. masses --      1.2311                 1.1182                 1.4232
 Frc consts  --      1.4484                 1.4506                 1.8656
 IR Inten    --      3.6476                 2.9737                 5.5882
 RamAct Fr= 1--      0.6520                13.9666                 4.2389
  Dep-P Fr= 1--      0.7143                 0.5434                 0.7367
  Dep-U Fr= 1--      0.8333                 0.7041                 0.8484
 Alpha2 Fr= 1--      0.0004                 0.0554                 0.0010
 Beta2  Fr= 1--      0.0906                 1.6391                 0.5994
 AlphaG Fr= 1--     -0.0017                -0.0077                -0.0045
 Gamma2 Fr= 1--      0.2013                -2.4656                -3.5942
 Delta2 Fr= 1--     -0.0764                -1.3429                 1.4569
 Raman1 Fr= 1--       2.608                 55.867                 16.956
 ROA1   Fr= 1--      16.881               -279.675               -298.418
 CID1   Fr= 1--       6.473                 -5.006                -17.600
 Raman2 Fr= 1--       1.087                 19.669                  7.192
 ROA2   Fr= 1--       5.442                -48.432                -97.915
 CID2   Fr= 1--       5.008                 -2.462                -13.614
 Raman3 Fr= 1--       2.173                 39.338                 14.385
 ROA3   Fr= 1--      16.881               -279.675               -298.418
 CID3   Fr= 1--       7.767                 -7.109                -20.745
 RC180  Fr= 1--       0.667                  0.408                  0.697
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.00   0.00   0.00    -0.00   0.01   0.00     0.09  -0.03  -0.01
     2   6    -0.00   0.01   0.00     0.01   0.01  -0.00    -0.05  -0.08  -0.00
     3   6     0.01  -0.00  -0.00    -0.02  -0.02   0.00    -0.03   0.05   0.01
     4   6     0.00  -0.00  -0.00    -0.01   0.02   0.00     0.07  -0.00  -0.01
     5   6    -0.01   0.00   0.00     0.02  -0.02  -0.00    -0.04  -0.05   0.00
     6   6    -0.00  -0.00  -0.00    -0.02  -0.01   0.00    -0.01   0.05   0.01
     7   6    -0.00   0.01  -0.01     0.00   0.00   0.00    -0.01  -0.00  -0.01
     8   6    -0.00   0.01   0.00     0.04   0.01   0.02     0.01   0.01   0.01
     9   6    -0.00  -0.00  -0.00     0.01  -0.07   0.01    -0.02   0.00  -0.00
    10   1     0.02  -0.02  -0.00     0.05  -0.04  -0.01    -0.25   0.26   0.05
    11   1    -0.01  -0.03  -0.00     0.01  -0.02  -0.00     0.01   0.34   0.02
    12   1    -0.03  -0.01   0.00     0.07   0.02  -0.01     0.01   0.07   0.00
    13   1     0.04   0.01  -0.00     0.09   0.03  -0.01    -0.06   0.05   0.01
    14   1    -0.00  -0.00  -0.01    -0.02  -0.02  -0.00     0.02   0.01  -0.00
    15   6     0.07  -0.10   0.06     0.00  -0.01  -0.00    -0.03  -0.04  -0.01
    16   1     0.03  -0.04   0.02    -0.16  -0.02  -0.35    -0.03   0.01  -0.06
    17   1     0.04  -0.03  -0.00    -0.36  -0.12   0.08    -0.06  -0.04   0.02
    18   1    -0.00   0.00  -0.00    -0.06   0.51   0.26     0.02  -0.04  -0.02
    19   1     0.03  -0.01   0.01    -0.02   0.36  -0.44     0.06  -0.02   0.03
    20   1    -0.35   0.45  -0.03     0.05   0.00   0.01     0.49   0.31   0.09
    21   1    -0.05   0.47  -0.32     0.00   0.06   0.06     0.03   0.04   0.45
    22   1    -0.36   0.22  -0.36    -0.06   0.01  -0.00    -0.08   0.14  -0.34
                     43                     44                     45
                      A                      A                      A
 Frequencies --   1499.0883              1499.5237              1503.0984
 Red. masses --      1.1196                 1.3717                 1.1064
 Frc consts  --      1.4825                 1.8172                 1.4727
 IR Inten    --      2.6461                 2.2977                 9.0771
 RamAct Fr= 1--      7.5220                 5.4820                 6.0063
  Dep-P Fr= 1--      0.2357                 0.7291                 0.7285
  Dep-U Fr= 1--      0.3814                 0.8433                 0.8429
 Alpha2 Fr= 1--      0.0928                 0.0020                 0.0022
 Beta2  Fr= 1--      0.4782                 0.7705                 0.8438
 AlphaG Fr= 1--     -0.0826                 0.0024                 0.0007
 Gamma2 Fr= 1--     -0.0241                 5.2665                -2.0103
 Delta2 Fr= 1--      0.9814                -0.0803                -0.8899
 Raman1 Fr= 1--      30.088                 21.928                 24.025
 ROA1   Fr= 1--      29.087                503.008               -221.466
 CID1   Fr= 1--       0.967                 22.939                 -9.218
 Raman2 Fr= 1--       5.738                  9.246                 10.126
 ROA2   Fr= 1--      -8.430                127.038                -41.129
 CID2   Fr= 1--      -1.469                 13.740                 -4.062
 Raman3 Fr= 1--      11.477                 18.492                 20.251
 ROA3   Fr= 1--      29.087                503.008               -221.466
 CID3   Fr= 1--       2.535                 27.201                -10.936
 RC180  Fr= 1--      -0.237                  0.687                  0.686
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.03  -0.01  -0.00    -0.08   0.01   0.01    -0.03   0.01   0.00
     2   6    -0.02  -0.02   0.00     0.04   0.08   0.00     0.02   0.02  -0.00
     3   6    -0.01   0.01   0.00     0.03  -0.04  -0.01    -0.00  -0.02  -0.00
     4   6     0.03   0.00  -0.00    -0.06  -0.01   0.01    -0.02   0.01   0.00
     5   6    -0.00  -0.02  -0.00     0.03   0.05   0.00     0.03   0.01  -0.00
     6   6    -0.01   0.02   0.00     0.03  -0.04  -0.01    -0.00  -0.02  -0.00
     7   6    -0.02   0.02   0.01    -0.03  -0.03  -0.01    -0.02  -0.00   0.01
     8   6    -0.05  -0.02  -0.02    -0.03  -0.00  -0.01     0.04   0.01   0.01
     9   6    -0.01  -0.04   0.01     0.02  -0.01  -0.00     0.01   0.02  -0.00
    10   1    -0.08   0.08   0.02     0.17  -0.21  -0.03     0.09  -0.08  -0.02
    11   1     0.00   0.10   0.01    -0.03  -0.33  -0.02     0.01  -0.09  -0.01
    12   1     0.00   0.02   0.00    -0.06  -0.08   0.00     0.03  -0.01  -0.00
    13   1    -0.03   0.01   0.00    -0.01  -0.06  -0.00     0.03  -0.01  -0.01
    14   1     0.04  -0.06   0.03     0.03   0.05  -0.00     0.04  -0.01   0.03
    15   6    -0.01   0.01   0.02    -0.02  -0.02  -0.02    -0.03   0.00   0.03
    16   1     0.16   0.03   0.38     0.12   0.02   0.26    -0.13   0.02  -0.27
    17   1     0.38   0.15  -0.08     0.27   0.10  -0.05    -0.28  -0.13   0.06
    18   1    -0.02   0.30   0.15    -0.02   0.11   0.05    -0.00  -0.16  -0.08
    19   1     0.02   0.22  -0.27    -0.02   0.06  -0.09    -0.02  -0.12   0.15
    20   1    -0.15   0.20  -0.02     0.46   0.22   0.08    -0.00   0.40   0.02
    21   1    -0.01  -0.32  -0.24     0.04   0.04   0.46     0.00  -0.42  -0.14
    22   1     0.36  -0.04  -0.16    -0.12   0.12  -0.26     0.45   0.03  -0.39
                     46                     47                     48
                      A                      A                      A
 Frequencies --   1515.4996              1628.0046              1650.5991
 Red. masses --      2.3931                 6.2034                 6.3481
 Frc consts  --      3.2383                 9.6871                10.1900
 IR Inten    --     16.8126                 0.4329                 1.1794
 RamAct Fr= 1--      2.2936                17.7374                28.3146
  Dep-P Fr= 1--      0.4050                 0.6043                 0.7351
  Dep-U Fr= 1--      0.5765                 0.7534                 0.8474
 Alpha2 Fr= 1--      0.0167                 0.0477                 0.0072
 Beta2  Fr= 1--      0.2204                 2.2272                 3.9988
 AlphaG Fr= 1--     -0.0175                -0.0430                 0.0226
 Gamma2 Fr= 1--      0.2947                 0.2635                 0.5514
 Delta2 Fr= 1--      0.0314                -0.6844                -0.0687
 Raman1 Fr= 1--       9.174                 70.950                113.258
 ROA1   Fr= 1--      29.297                  3.396                 50.733
 CID1   Fr= 1--       3.193                  0.048                  0.448
 Raman2 Fr= 1--       2.645                 26.726                 47.985
 ROA2   Fr= 1--       6.822                 11.799                 13.783
 CID2   Fr= 1--       2.580                  0.441                  0.287
 Raman3 Fr= 1--       5.289                 53.452                 95.971
 ROA3   Fr= 1--      29.297                  3.396                 50.733
 CID3   Fr= 1--       5.539                  0.064                  0.529
 RC180  Fr= 1--       0.153                  0.507                  0.695
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.01   0.07   0.00     0.18  -0.28  -0.04     0.20  -0.01  -0.02
     2   6     0.07  -0.03  -0.01    -0.03   0.34   0.03    -0.14  -0.12   0.01
     3   6    -0.15  -0.07   0.01     0.09  -0.14  -0.02     0.33   0.11  -0.03
     4   6     0.02   0.17   0.01    -0.19   0.23   0.04    -0.29  -0.03   0.03
     5   6     0.13  -0.10  -0.02    -0.00  -0.31  -0.02     0.23   0.16  -0.01
     6   6    -0.15  -0.06   0.01    -0.01   0.17   0.01    -0.32  -0.13   0.03
     7   6    -0.03   0.03   0.00     0.01   0.03   0.00    -0.03  -0.02   0.00
     8   6    -0.02  -0.01  -0.01     0.02   0.00  -0.00     0.00  -0.01  -0.00
     9   6    -0.00  -0.02  -0.01     0.03  -0.01  -0.01     0.04   0.01  -0.00
    10   1     0.24  -0.09  -0.03    -0.39   0.18   0.06    -0.05   0.21   0.02
    11   1     0.12   0.17  -0.00    -0.17  -0.42  -0.01    -0.11   0.18   0.02
    12   1     0.50   0.19  -0.04    -0.02  -0.20  -0.01    -0.41  -0.18   0.03
    13   1     0.52   0.19  -0.04    -0.18   0.12   0.03     0.43   0.15  -0.03
    14   1    -0.04  -0.04  -0.00    -0.04  -0.04  -0.01    -0.02   0.02  -0.00
    15   6    -0.00  -0.01  -0.01    -0.01  -0.00   0.00     0.00   0.01  -0.00
    16   1     0.08   0.01   0.17     0.02   0.01   0.00    -0.01   0.03   0.00
    17   1     0.17   0.07  -0.03    -0.01  -0.00   0.00    -0.01   0.03   0.00
    18   1    -0.06  -0.14  -0.06    -0.05  -0.07  -0.04    -0.00   0.02   0.01
    19   1    -0.11  -0.14   0.11    -0.14  -0.09   0.07    -0.08  -0.00  -0.01
    20   1     0.07  -0.02   0.01    -0.01  -0.02   0.00     0.03   0.01   0.00
    21   1     0.00   0.06   0.09    -0.01   0.02  -0.04     0.01  -0.04   0.05
    22   1    -0.07   0.01   0.02     0.03  -0.02   0.03    -0.01   0.02  -0.02
                     49                     50                     51
                      A                      A                      A
 Frequencies --   2975.1996              3010.4162              3027.1549
 Red. masses --      1.0817                 1.0712                 1.0386
 Frc consts  --      5.6412                 5.7196                 5.6073
 IR Inten    --     22.0783                29.9334                13.4248
 RamAct Fr= 1--    225.0867               235.5036               123.5272
  Dep-P Fr= 1--      0.1789                 0.1686                 0.0372
  Dep-U Fr= 1--      0.3035                 0.2885                 0.0718
 Alpha2 Fr= 1--      3.2306                 3.4717                 2.5153
 Beta2  Fr= 1--     11.3869                11.3256                 1.4772
 AlphaG Fr= 1--      0.1370                -0.1470                 0.0338
 Gamma2 Fr= 1--      7.1193                -8.7468                 4.9115
 Delta2 Fr= 1--      1.0630                 7.7764                 4.4696
 Raman1 Fr= 1--     900.347                942.014                494.109
 ROA1   Fr= 1--     717.466               -590.848                614.532
 CID1   Fr= 1--       0.797                 -0.627                  1.244
 Raman2 Fr= 1--     136.642                135.907                 17.726
 ROA2   Fr= 1--     162.358               -272.134                 82.119
 CID2   Fr= 1--       1.188                 -2.002                  4.633
 Raman3 Fr= 1--     273.284                271.814                 35.453
 ROA3   Fr= 1--     717.466               -590.848                614.532
 CID3   Fr= 1--       2.625                 -2.174                 17.334
 RC180  Fr= 1--      -0.393                 -0.423                 -0.856
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.00  -0.00  -0.00     0.00  -0.00  -0.00    -0.00  -0.00   0.00
     2   6     0.00   0.00   0.00     0.00   0.00  -0.00    -0.00  -0.00  -0.00
     3   6     0.00  -0.00  -0.00    -0.00  -0.00   0.00     0.00   0.00   0.00
     4   6     0.00   0.00   0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
     5   6     0.00   0.00  -0.00     0.00  -0.00  -0.00     0.00   0.00  -0.00
     6   6    -0.00  -0.00   0.00    -0.00   0.00   0.00     0.00  -0.00  -0.00
     7   6     0.02  -0.00  -0.08    -0.00   0.00   0.00    -0.00  -0.00   0.00
     8   6    -0.00  -0.00   0.01    -0.00  -0.00   0.01     0.01   0.00   0.02
     9   6    -0.00   0.00  -0.00     0.00   0.05  -0.06     0.00  -0.01   0.00
    10   1    -0.00  -0.00  -0.00    -0.00  -0.00  -0.00    -0.00   0.00  -0.00
    11   1    -0.00   0.00  -0.00    -0.00   0.00   0.00    -0.00  -0.00   0.00
    12   1    -0.00   0.00   0.00    -0.00   0.01   0.00     0.00  -0.00  -0.00
    13   1     0.00  -0.00  -0.00     0.00  -0.00  -0.00    -0.00   0.01   0.00
    14   1    -0.19   0.05   0.96     0.01  -0.00  -0.04     0.00   0.00  -0.02
    15   6    -0.00   0.00   0.01    -0.00   0.00  -0.00    -0.02   0.03  -0.03
    16   1     0.04   0.01  -0.02     0.04   0.02  -0.02    -0.11  -0.05   0.07
    17   1    -0.02   0.01  -0.11    -0.03   0.01  -0.14    -0.05   0.02  -0.32
    18   1    -0.00  -0.01   0.02    -0.04  -0.39   0.87     0.00   0.02  -0.06
    19   1    -0.00   0.00   0.00     0.02  -0.14  -0.16    -0.00   0.05   0.05
    20   1     0.02  -0.00  -0.08    -0.01   0.00   0.03    -0.12   0.01   0.57
    21   1     0.03   0.01  -0.00     0.02   0.00  -0.00     0.53   0.06  -0.07
    22   1    -0.01  -0.03  -0.01    -0.00  -0.01  -0.01    -0.14  -0.42  -0.19
                     52                     53                     54
                      A                      A                      A
 Frequencies --   3032.3421              3072.4018              3087.7679
 Red. masses --      1.0614                 1.0903                 1.1012
 Frc consts  --      5.7504                 6.0640                 6.1862
 IR Inten    --     48.5007                32.5621                 3.5992
 RamAct Fr= 1--    143.1806               162.0030                57.2683
  Dep-P Fr= 1--      0.0881                 0.2315                 0.6150
  Dep-U Fr= 1--      0.1620                 0.3760                 0.7616
 Alpha2 Fr= 1--      2.5805                 2.0208                 0.1418
 Beta2  Fr= 1--      3.8657                10.1526                 7.2697
 AlphaG Fr= 1--      0.1499                -2.0983                 0.0810
 Gamma2 Fr= 1--     -6.7674               -14.2380               -52.3978
 Delta2 Fr= 1--     -9.8229                -8.8765               -36.3994
 Raman1 Fr= 1--     572.722                648.012                229.073
 ROA1   Fr= 1--    -964.002              -1650.900              -6194.975
 CID1   Fr= 1--      -1.683                 -2.548                -27.044
 Raman2 Fr= 1--      46.388                121.831                 87.236
 ROA2   Fr= 1--     -83.834               -270.701               -966.353
 CID2   Fr= 1--      -1.807                 -2.222                -11.077
 Raman3 Fr= 1--      92.777                243.662                174.472
 ROA3   Fr= 1--    -964.002              -1650.900              -6194.975
 CID3   Fr= 1--     -10.391                 -6.775                -35.507
 RC180  Fr= 1--      -0.676                 -0.248                  0.523
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00  -0.00  -0.00    -0.00   0.00   0.00    -0.00   0.00   0.00
     2   6    -0.00   0.00  -0.00    -0.00  -0.00   0.00    -0.00  -0.00  -0.00
     3   6    -0.00  -0.00  -0.00    -0.00   0.00   0.00     0.00   0.00  -0.00
     4   6     0.00   0.00   0.00     0.00   0.00  -0.00     0.00   0.00   0.00
     5   6     0.00   0.00  -0.00     0.00   0.00  -0.00     0.00   0.00   0.00
     6   6     0.00  -0.00  -0.00     0.00  -0.00  -0.00     0.00  -0.00  -0.00
     7   6     0.00  -0.00  -0.01    -0.00   0.00   0.00     0.00   0.00  -0.00
     8   6    -0.03  -0.01  -0.05    -0.02  -0.01   0.00    -0.04  -0.02   0.05
     9   6    -0.00   0.01   0.01     0.01  -0.05  -0.07    -0.00   0.00   0.02
    10   1     0.00   0.00   0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
    11   1     0.00  -0.00   0.00    -0.00  -0.00  -0.00     0.00  -0.00   0.00
    12   1    -0.00   0.00   0.00     0.00  -0.01  -0.00     0.00   0.00   0.00
    13   1    -0.00   0.01   0.00    -0.00   0.00   0.00    -0.00   0.00  -0.00
    14   1    -0.02   0.00   0.07     0.00  -0.00  -0.01    -0.00  -0.00   0.00
    15   6    -0.01   0.01  -0.01     0.00   0.00  -0.00     0.04  -0.00  -0.05
    16   1     0.27   0.12  -0.17     0.20   0.08  -0.11     0.54   0.23  -0.29
    17   1     0.14  -0.05   0.82     0.01  -0.01   0.09    -0.05   0.01  -0.25
    18   1    -0.00  -0.02   0.06    -0.01  -0.10   0.17     0.00   0.05  -0.09
    19   1     0.01  -0.13  -0.13    -0.08   0.69   0.63     0.01  -0.10  -0.09
    20   1    -0.04   0.00   0.20    -0.00  -0.00   0.02    -0.09   0.01   0.49
    21   1     0.21   0.02  -0.03    -0.00  -0.00   0.00    -0.47  -0.05   0.05
    22   1    -0.06  -0.20  -0.08    -0.00  -0.01  -0.00     0.03   0.06   0.01
                     55                     56                     57
                      A                      A                      A
 Frequencies --   3089.9642              3093.2323              3160.9321
 Red. masses --      1.1009                 1.1013                 1.0856
 Frc consts  --      6.1929                 6.2082                 6.3910
 IR Inten    --     54.3604                47.0453                 5.9444
 RamAct Fr= 1--    171.0690                98.0223                34.4228
  Dep-P Fr= 1--      0.5816                 0.4463                 0.6142
  Dep-U Fr= 1--      0.7354                 0.6171                 0.7610
 Alpha2 Fr= 1--      0.5398                 0.6100                 0.0858
 Beta2  Fr= 1--     20.9685                10.0821                 4.3661
 AlphaG Fr= 1--      0.7426                -0.8128                -0.0394
 Gamma2 Fr= 1--     14.1908                53.0093                -0.4045
 Delta2 Fr= 1--      0.9102                44.9496                 0.7149
 Raman1 Fr= 1--     684.276                392.089                137.691
 ROA1   Fr= 1--    1391.445               6527.279                -15.954
 CID1   Fr= 1--       2.033                 16.647                 -0.116
 Raman2 Fr= 1--     251.622                120.985                 52.393
 ROA2   Fr= 1--     333.297                912.627                -15.427
 CID2   Fr= 1--       1.325                  7.543                 -0.294
 Raman3 Fr= 1--     503.245                241.970                104.786
 ROA3   Fr= 1--    1391.445               6527.279                -15.954
 CID3   Fr= 1--       2.765                 26.976                 -0.152
 RC180  Fr= 1--       0.471                  0.234                  0.522
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00  -0.00  -0.00     0.00  -0.00  -0.00     0.02   0.03  -0.00
     2   6    -0.00  -0.00   0.00     0.00   0.00   0.00    -0.04   0.01   0.01
     3   6    -0.00   0.00  -0.00    -0.00  -0.00   0.00     0.02  -0.05  -0.01
     4   6     0.00  -0.00   0.00    -0.00   0.00  -0.00    -0.00  -0.00   0.00
     5   6     0.00  -0.00   0.00    -0.00  -0.00   0.00     0.00   0.00  -0.00
     6   6    -0.00   0.00   0.00    -0.00   0.00   0.00     0.01  -0.03  -0.00
     7   6    -0.00  -0.00   0.00     0.00  -0.00  -0.01    -0.00  -0.00  -0.00
     8   6    -0.03  -0.01   0.03     0.03   0.01  -0.03     0.00   0.00  -0.00
     9   6    -0.00   0.00   0.01     0.00  -0.00  -0.01     0.00  -0.00  -0.00
    10   1     0.00   0.00   0.00     0.00   0.00  -0.00    -0.26  -0.31   0.01
    11   1     0.00   0.00   0.00    -0.00   0.00   0.00     0.49  -0.08  -0.06
    12   1     0.00  -0.00   0.00    -0.00  -0.00  -0.00    -0.23   0.62   0.08
    13   1     0.01  -0.02  -0.00     0.01  -0.02  -0.00    -0.12   0.33   0.04
    14   1     0.01  -0.00  -0.04    -0.02   0.01   0.11    -0.00   0.00   0.00
    15   6    -0.07  -0.05  -0.00     0.00  -0.04  -0.07    -0.00  -0.00  -0.00
    16   1     0.34   0.14  -0.18    -0.38  -0.16   0.20    -0.00  -0.00   0.00
    17   1    -0.03   0.01  -0.15     0.04  -0.01   0.21     0.00   0.00   0.00
    18   1     0.00   0.03  -0.05    -0.00  -0.03   0.06     0.00   0.00  -0.00
    19   1     0.01  -0.05  -0.05    -0.01   0.06   0.05     0.00   0.01   0.01
    20   1     0.00  -0.01  -0.10    -0.12  -0.01   0.57    -0.00  -0.00   0.00
    21   1     0.65   0.06  -0.09    -0.09  -0.02  -0.00     0.00   0.00  -0.00
    22   1     0.16   0.53   0.23     0.17   0.53   0.21     0.00   0.01   0.00
                     58                     59                     60
                      A                      A                      A
 Frequencies --   3167.0193              3178.1278              3191.0599
 Red. masses --      1.0880                 1.0920                 1.0966
 Frc consts  --      6.4296                 6.4987                 6.5791
 IR Inten    --      2.1158                28.2482                22.0176
 RamAct Fr= 1--    146.4018                65.5187               303.6418
  Dep-P Fr= 1--      0.5705                 0.7462                 0.1151
  Dep-U Fr= 1--      0.7265                 0.8546                 0.2064
 Alpha2 Fr= 1--      0.4959                 0.0043                 5.1228
 Beta2  Fr= 1--     17.7265                 9.3323                10.4454
 AlphaG Fr= 1--      0.0375                -0.0193                 0.3564
 Gamma2 Fr= 1--      0.5611                 0.2978                 2.8845
 Delta2 Fr= 1--      0.3636                -3.2376                 2.8834
 Raman1 Fr= 1--     585.607                262.075               1214.567
 ROA1   Fr= 1--      65.495                -75.014                369.184
 CID1   Fr= 1--       0.112                 -0.286                  0.304
 Raman2 Fr= 1--     212.718                111.988                125.345
 ROA2   Fr= 1--      10.557                 33.048                 46.162
 CID2   Fr= 1--       0.050                  0.295                  0.368
 Raman3 Fr= 1--     425.435                223.976                250.690
 ROA3   Fr= 1--      65.495                -75.014                369.184
 CID3   Fr= 1--       0.154                 -0.335                  1.473
 RC180  Fr= 1--       0.453                  0.709                 -0.587
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.02   0.03  -0.00     0.03   0.03  -0.00    -0.04  -0.05   0.00
     2   6     0.01  -0.00  -0.00    -0.05   0.01   0.01    -0.06   0.01   0.01
     3   6    -0.02   0.05   0.01    -0.01   0.03   0.00    -0.01   0.02   0.00
     4   6     0.00   0.00  -0.00     0.00  -0.00  -0.00     0.00   0.00  -0.00
     5   6     0.00   0.00  -0.00    -0.00  -0.00   0.00     0.00   0.00  -0.00
     6   6     0.02  -0.06  -0.01    -0.02   0.04   0.01     0.01  -0.02  -0.00
     7   6     0.00  -0.00  -0.00    -0.00   0.00   0.00     0.00  -0.00  -0.00
     8   6     0.00   0.00  -0.00    -0.00  -0.00   0.00     0.00   0.00   0.00
     9   6    -0.00   0.00   0.00    -0.00   0.00   0.00    -0.00   0.00   0.00
    10   1    -0.28  -0.34   0.01    -0.30  -0.35   0.01     0.42   0.50  -0.01
    11   1    -0.09   0.02   0.01     0.55  -0.09  -0.07     0.63  -0.10  -0.08
    12   1     0.20  -0.52  -0.06     0.14  -0.38  -0.05     0.08  -0.23  -0.03
    13   1    -0.23   0.65   0.07     0.18  -0.51  -0.06    -0.10   0.28   0.03
    14   1    -0.00  -0.00   0.00     0.00   0.00  -0.00    -0.00   0.00   0.00
    15   6    -0.00  -0.00  -0.00     0.00   0.00   0.00    -0.00  -0.00  -0.00
    16   1    -0.00  -0.00   0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
    17   1     0.00   0.00  -0.00    -0.00  -0.00  -0.00    -0.00   0.00  -0.00
    18   1    -0.00  -0.00   0.00    -0.00  -0.00   0.00    -0.00  -0.00   0.00
    19   1    -0.00  -0.01  -0.01    -0.00  -0.00  -0.00    -0.00  -0.00  -0.00
    20   1    -0.00  -0.00   0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
    21   1     0.00   0.00  -0.00    -0.00  -0.00   0.00    -0.00   0.00  -0.00
    22   1     0.01   0.02   0.01    -0.00  -0.01  -0.01     0.00   0.01   0.00

 -------------------
 - Thermochemistry -
 -------------------
 Temperature   298.150 Kelvin.  Pressure   1.00000 Atm.
 Atom     1 has atomic number  6 and mass  12.00000
 Atom     2 has atomic number  6 and mass  12.00000
 Atom     3 has atomic number  6 and mass  12.00000
 Atom     4 has atomic number  6 and mass  12.00000
 Atom     5 has atomic number  6 and mass  12.00000
 Atom     6 has atomic number  6 and mass  12.00000
 Atom     7 has atomic number  6 and mass  12.00000
 Atom     8 has atomic number  6 and mass  12.00000
 Atom     9 has atomic number  6 and mass  12.00000
 Atom    10 has atomic number  1 and mass   1.00783
 Atom    11 has atomic number  1 and mass   1.00783
 Atom    12 has atomic number  1 and mass   1.00783
 Atom    13 has atomic number  1 and mass   1.00783
 Atom    14 has atomic number  1 and mass   1.00783
 Atom    15 has atomic number  6 and mass  12.00000
 Atom    16 has atomic number  1 and mass   1.00783
 Atom    17 has atomic number  1 and mass   1.00783
 Atom    18 has atomic number  1 and mass   1.00783
 Atom    19 has atomic number  1 and mass   1.00783
 Atom    20 has atomic number  1 and mass   1.00783
 Atom    21 has atomic number  1 and mass   1.00783
 Atom    22 has atomic number  1 and mass   1.00783
 Molecular mass:   132.09390 amu.
 Principal axes and moments of inertia in atomic units:
                           1         2         3
     Eigenvalues --   754.660911465.567862134.52425
           X            0.99990  -0.01400   0.00153
           Y            0.01401   0.99990  -0.00236
           Z           -0.00150   0.00238   1.00000
 This molecule is an asymmetric top.
 Rotational symmetry number  1.
 Warning -- assumption of classical behavior for rotation
           may cause significant error
 Rotational temperatures (Kelvin)      0.11477     0.05910     0.04058
 Rotational constants (GHZ):           2.39146     1.23143     0.84550
 Zero-point vibrational energy     504249.2 (Joules/Mol)
                                  120.51845 (Kcal/Mol)
 Warning -- explicit consideration of  11 degrees of freedom as
           vibrations may cause significant error
 Vibrational temperatures:    153.01   214.52   304.21   342.74   380.22
          (Kelvin)            571.91   609.32   660.34   748.09   768.79
                              853.78   894.16  1054.05  1081.05  1104.70
                             1172.50  1234.12  1268.81  1321.23  1346.69
                             1383.98  1395.29  1414.20  1492.31  1515.07
                             1586.09  1591.81  1626.48  1701.10  1704.54
                             1718.16  1752.08  1787.75  1866.12  1878.97
                             1905.96  1920.85  1955.21  1967.55  2033.12
                             2134.94  2146.11  2156.85  2157.48  2162.62
                             2180.47  2342.34  2374.84  4280.65  4331.32
                             4355.40  4362.86  4420.50  4442.61  4445.77
                             4450.47  4547.88  4556.63  4572.62  4591.22
 
 Zero-point correction=                           0.192058 (Hartree/Particle)
 Thermal correction to Energy=                    0.200364
 Thermal correction to Enthalpy=                  0.201308
 Thermal correction to Gibbs Free Energy=         0.159215
 Sum of electronic and zero-point Energies=           -388.292300
 Sum of electronic and thermal Energies=              -388.283994
 Sum of electronic and thermal Enthalpies=            -388.283050
 Sum of electronic and thermal Free Energies=         -388.325143
 
                     E (Thermal)             CV                S
                      KCal/Mol        Cal/Mol-Kelvin    Cal/Mol-Kelvin
 Total                  125.730             33.807             88.593
 Electronic               0.000              0.000              0.000
 Translational            0.889              2.981             40.548
 Rotational               0.889              2.981             29.247
 Vibrational            123.953             27.846             18.798
 Vibration     1          0.605              1.944              3.334
 Vibration     2          0.618              1.904              2.684
 Vibration     3          0.643              1.823              2.031
 Vibration     4          0.656              1.782              1.816
 Vibration     5          0.671              1.738              1.633
 Vibration     6          0.764              1.475              0.972
 Vibration     7          0.786              1.419              0.880
 Vibration     8          0.817              1.341              0.769
 Vibration     9          0.875              1.206              0.610
 Vibration    10          0.889              1.174              0.578
 Vibration    11          0.951              1.046              0.461
                       Q            Log10(Q)             Ln(Q)
 Total Bot       0.583844D-73        -73.233703       -168.626833
 Total V=0       0.127920D+16         15.106939         34.785013
 Vib (Bot)       0.177887D-86        -86.749856       -199.748926
 Vib (Bot)    1  0.192730D+01          0.284950          0.656122
 Vib (Bot)    2  0.136029D+01          0.133631          0.307697
 Vib (Bot)    3  0.938816D+00         -0.027420         -0.063136
 Vib (Bot)    4  0.823777D+00         -0.084190         -0.193855
 Vib (Bot)    5  0.733437D+00         -0.134637         -0.310013
 Vib (Bot)    6  0.449216D+00         -0.347545         -0.800251
 Vib (Bot)    7  0.413505D+00         -0.383520         -0.883086
 Vib (Bot)    8  0.370916D+00         -0.430725         -0.991781
 Vib (Bot)    9  0.310454D+00         -0.508003         -1.169720
 Vib (Bot)   10  0.298092D+00         -0.525649         -1.210352
 Vib (Bot)   11  0.253337D+00         -0.596301         -1.373035
 Vib (V=0)       0.389750D+02          1.590786          3.662920
 Vib (V=0)    1  0.249110D+01          0.396392          0.912726
 Vib (V=0)    2  0.194927D+01          0.289872          0.667455
 Vib (V=0)    3  0.156366D+01          0.194143          0.447030
 Vib (V=0)    4  0.146364D+01          0.165435          0.380929
 Vib (V=0)    5  0.138765D+01          0.142281          0.327615
 Vib (V=0)    6  0.117216D+01          0.068986          0.158846
 Vib (V=0)    7  0.114883D+01          0.060257          0.138748
 Vib (V=0)    8  0.112256D+01          0.050209          0.115610
 Vib (V=0)    9  0.108854D+01          0.036845          0.084839
 Vib (V=0)   10  0.108212D+01          0.034274          0.078918
 Vib (V=0)   11  0.106052D+01          0.025518          0.058757
 Electronic      0.100000D+01          0.000000          0.000000
 Translational   0.596730D+08          7.775778         17.904391
 Rotational      0.550016D+06          5.740375         13.217702
 
                                                          ROA calculations.
                                                             IR Spectrum
 
   333333333332                                                   11111111111111111111 11111                                         
   111100000009                                                   66555444433333222111 111009999988 8777    65 55 4 43    222  11    
   976699873217                                                   52100998165320941988 300538763185 1653    29 32 5 29    631  40    
   187130822705                                                   18530924389556738452 062373026828 5813    13 40 9 37    481  96    
 
   XXXXXXXXXXXX                                                   XXXXXXXXXXXXXXXX XXX XXXXXXX XXXX XXXX    XX XX X XX    X X  X     
   XX XXX XXXXX                                                     XX  X  XX                        XX           X                  
   XX  XX XXXXX                                                     XX                               XX                              
   XX  XX XXXXX                                                     X                                XX                              
   XX  XX XXXXX                                                     X                                XX                              
   XX  XX XX XX                                                     X                                XX                              
   XX  XX XX XX                                                                                      XX                              
   XX  XX XX XX                                                                                      X                               
    X  XX XX X                                                                                       X                               
    X  XX XX X                                                                                       X                               
       XX XX X                                                                                       X                               
       XX XX                                                                                         X                               
       XX  X                                                                                         X                               
       XX  X                                                                                         X                               
       XX  X                                                                                                                         
       XX  X                                                                                                                         
       XX  X                                                                                                                         
        X  X                                                                                                                         
        X                                                                                                                            
        X                                                                                                                            
 
 ***** Axes restored to original set *****
 -------------------------------------------------------------------
 Center     Atomic                   Forces (Hartrees/Bohr)
 Number     Number              X              Y              Z
 -------------------------------------------------------------------
      1        6          -0.000002085   -0.000006530    0.000001263
      2        6           0.000006560   -0.000001017   -0.000006946
      3        6           0.000000078   -0.000004377    0.000003077
      4        6           0.000002773    0.000008929    0.000000518
      5        6          -0.000015820    0.000013508    0.000003209
      6        6          -0.000001967    0.000001316   -0.000001321
      7        6           0.000009431   -0.000006724    0.000002191
      8        6           0.000000702    0.000001906    0.000003993
      9        6          -0.000001293   -0.000007184   -0.000000782
     10        1          -0.000000442   -0.000000205    0.000000005
     11        1           0.000000225   -0.000000429    0.000000023
     12        1           0.000000010    0.000000447   -0.000000414
     13        1           0.000001297   -0.000000295   -0.000001106
     14        1           0.000000957   -0.000000083   -0.000000071
     15        6          -0.000003738   -0.000000406    0.000000295
     16        1          -0.000000323    0.000001379   -0.000000358
     17        1          -0.000000835    0.000000397   -0.000003222
     18        1           0.000001117   -0.000000020   -0.000000430
     19        1          -0.000001342   -0.000000500   -0.000001205
     20        1           0.000001368   -0.000001377    0.000000185
     21        1           0.000000210    0.000000992    0.000000039
     22        1           0.000003118    0.000000275    0.000001056
 -------------------------------------------------------------------
 Cartesian Forces:  Max     0.000015820 RMS     0.000003841
 End of FrcOut F.D. properties on file   721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) frequency  1    0.085645:
                 1             2             3 
      1   0.150965D+03  0.204140D+01 -0.374916D+01
      2   0.204140D+01  0.131534D+03  0.139921D+01
      3  -0.374916D+01  0.139921D+01  0.825280D+02
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.085645:
                 1             2             3 
      1   0.594273D+00  0.118599D+01  0.225830D+01
      2   0.109170D+02 -0.625041D+01  0.124606D+02
      3   0.846427D+00  0.345263D+02  0.557830D+01
 Property number 4 -- D-Q polarizability frequency  1    0.085645:
                 1             2             3 
      1  -0.785182D+02 -0.170177D+02  0.145421D+02
      2   0.415405D+02  0.297206D+01 -0.144033D+02
      3   0.369777D+02  0.140457D+02 -0.138853D+00
      4  -0.294998D+02 -0.338898D+02 -0.114866D+02
      5   0.145997D+02 -0.148645D+02  0.321895D+02
      6  -0.817230D+01 -0.159724D+01  0.220771D+00
 End of FrcOut F.D. properties on file   722 Mask=       B NFrqRd=     1 NDeriv=    66 ND12= 1 LenFil=    2379:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1   0.127564D+01 -0.116500D+01 -0.948715D+00 -0.665283D+01 -0.248537D+00
      2  -0.116500D+01 -0.295529D+01 -0.787586D+00 -0.248537D+00 -0.237876D+01
      3  -0.948715D+00 -0.787586D+00 -0.160034D+01  0.751143D+00  0.618032D+00
                 6             7             8             9            10 
      1   0.751143D+00 -0.152872D+01 -0.128048D+00 -0.376598D+01 -0.566647D+01
      2   0.618032D+00 -0.128048D+00  0.530581D+00 -0.409651D+01  0.991047D+00
      3  -0.319970D+01 -0.376598D+01 -0.409651D+01 -0.331748D-01 -0.588161D+00
                11            12            13            14            15 
      1   0.991047D+00 -0.588161D+00  0.249612D+01  0.309202D+01  0.174735D+00
      2  -0.292805D+01 -0.241269D-01  0.309202D+01  0.245064D+01 -0.513259D+00
      3  -0.241269D-01 -0.318951D+01  0.174735D+00 -0.513259D+00  0.112432D+01
                16            17            18            19            20 
      1  -0.593364D+00  0.674284D+00 -0.573666D+01  0.132353D+01 -0.360782D+01
      2   0.674284D+00  0.324373D+00  0.773644D+00 -0.360782D+01 -0.393758D+01
      3  -0.573666D+01  0.773644D+00  0.154573D+01 -0.211839D+00  0.565614D+00
                21            22            23            24            25 
      1  -0.211839D+00  0.580245D+01 -0.677072D+00 -0.125964D+00  0.467603D+00
      2   0.565614D+00 -0.677072D+00  0.598920D+00 -0.505932D+00  0.992523D+00
      3  -0.413817D+00 -0.125964D+00 -0.505932D+00  0.270711D+01 -0.249238D+01
                26            27            28            29            30 
      1   0.992523D+00 -0.249238D+01  0.796982D+00  0.317735D+01 -0.400052D+00
      2  -0.515374D+00  0.372381D+01  0.317735D+01  0.762872D+01 -0.222389D+00
      3   0.372381D+01  0.156349D+01 -0.400052D+00 -0.222389D+00  0.191219D+01
                31            32            33            34            35 
      1   0.134786D+02  0.465664D+01 -0.120510D+01  0.176140D+01 -0.365044D+00
      2   0.465664D+01  0.730059D+01 -0.680353D+00 -0.365044D+00 -0.328726D+00
      3  -0.120510D+01 -0.680353D+00  0.166664D+01  0.154604D+01  0.302788D+01
                36            37            38            39            40 
      1   0.154604D+01  0.174812D+02 -0.197256D+01 -0.239433D+01 -0.661500D+01
      2   0.302788D+01 -0.197256D+01  0.413059D+01  0.299662D-01 -0.343213D+01
      3   0.179385D-03 -0.239433D+01  0.299662D-01  0.252358D+01  0.467922D-01
                41            42            43            44            45 
      1  -0.343213D+01  0.467922D-01 -0.178052D+01 -0.553224D+00  0.323398D+01
      2  -0.632675D+00  0.583718D+00 -0.553224D+00  0.339965D+00 -0.815085D+00
      3   0.583718D+00  0.296712D+00  0.323398D+01 -0.815085D+00 -0.140092D+01
                46            47            48            49            50 
      1  -0.260087D+01  0.383307D+01  0.442648D+00 -0.659575D+01  0.702274D+00
      2   0.383307D+01  0.264658D+01 -0.312948D+00  0.702274D+00 -0.215022D+01
      3   0.442648D+00 -0.312948D+00  0.112382D+01  0.261925D+00  0.459441D+00
                51            52            53            54            55 
      1   0.261925D+00  0.190317D+00 -0.404297D+00  0.410406D+00 -0.556144D+01
      2   0.459441D+00 -0.404297D+00  0.498723D-01 -0.424017D+01  0.291094D+01
      3  -0.245034D+01  0.410406D+00 -0.424017D+01 -0.130089D+01  0.149990D+01
                56            57            58            59            60 
      1   0.291094D+01  0.149990D+01  0.348248D+01 -0.381221D+01  0.293605D+00
      2  -0.253986D+01  0.300866D+00 -0.381221D+01 -0.211327D+01 -0.170092D+01
      3   0.300866D+00 -0.257384D+01  0.293605D+00 -0.170092D+01  0.833074D+00
                61            62            63            64            65 
      1   0.407268D+01  0.185588D+00 -0.369680D+01 -0.485762D+01 -0.413112D+01
      2   0.185588D+00 -0.239108D+01  0.344757D+00 -0.413112D+01  0.137255D+01
      3  -0.369680D+01  0.344757D+00  0.957583D+01  0.229759D+01  0.746061D+00
                66            67            68            69            70 
      1   0.229759D+01 -0.396510D+01  0.681649D+00  0.979761D+00  0.410571D+01
      2   0.746061D+00  0.681649D+00  0.272460D+01  0.141556D+01  0.190806D+01
      3  -0.149754D+01  0.979761D+00  0.141556D+01  0.516778D+00 -0.278087D+01
                71            72            73            74            75 
      1   0.190806D+01 -0.278087D+01 -0.263896D+01  0.536084D+00 -0.535756D-01
      2   0.172016D+01  0.821190D-01  0.536084D+00 -0.273931D+01  0.111180D+01
      3   0.821190D-01 -0.659399D+01 -0.535756D-01  0.111180D+01 -0.244603D+00
                76            77            78            79            80 
      1  -0.164418D+00 -0.450552D+01  0.117693D+01  0.974023D+00  0.221166D+01
      2  -0.450552D+01 -0.919360D+01 -0.338313D+00  0.221166D+01  0.394732D+00
      3   0.117693D+01 -0.338313D+00 -0.388554D+01 -0.165720D+01 -0.658772D+01
                81            82            83            84            85 
      1  -0.165720D+01 -0.580286D+01 -0.440530D+01  0.222616D+00 -0.419067D+01
      2  -0.658772D+01 -0.440530D+01 -0.378822D+01  0.192987D+00 -0.495672D+01
      3   0.383695D+01  0.222616D+00  0.192987D+00 -0.458725D+00 -0.501283D-01
                86            87            88            89            90 
      1  -0.495672D+01 -0.501283D-01  0.358603D+00  0.178363D+00  0.124226D+00
      2  -0.680346D+01 -0.635646D-02  0.178363D+00 -0.386215D-01  0.122062D+00
      3  -0.635646D-02 -0.537197D+00  0.124226D+00  0.122062D+00  0.419045D-02
                91            92            93            94            95 
      1  -0.137150D+02  0.140153D+01  0.148866D+01  0.155048D+01 -0.183144D+01
      2   0.140153D+01 -0.783156D+00 -0.168866D+00 -0.183144D+01  0.518129D+00
      3   0.148866D+01 -0.168866D+00 -0.867938D+00 -0.311558D+00  0.210970D+00
                96            97            98            99           100 
      1  -0.311558D+00  0.172130D+01 -0.328033D+00 -0.100880D-01 -0.226355D+01
      2   0.210970D+00 -0.328033D+00  0.176184D+00  0.303757D-01  0.253319D+01
      3   0.152733D+00 -0.100880D-01  0.303757D-01  0.798595D-01  0.366990D+00
               101           102           103           104           105 
      1   0.253319D+01  0.366990D+00  0.239694D+01 -0.391256D+01 -0.416308D+00
      2  -0.279341D+01 -0.415273D+00 -0.391256D+01  0.940551D+01  0.101370D+01
      3  -0.415273D+00 -0.394341D+00 -0.416308D+00  0.101370D+01  0.795023D+00
               106           107           108           109           110 
      1   0.331093D+00 -0.557846D+00 -0.109890D+00  0.128911D+01 -0.169305D+01
      2  -0.557846D+00  0.117387D+01  0.174355D+00 -0.169305D+01  0.202166D+01
      3  -0.109890D+00  0.174355D+00  0.559529D-01 -0.143697D+00  0.326053D+00
               111           112           113           114           115 
      1  -0.143697D+00 -0.123656D+01  0.177586D+01  0.140296D+00 -0.212660D+00
      2   0.326053D+00  0.177586D+01 -0.958957D+01 -0.992230D+00  0.259697D+00
      3   0.129134D+00  0.140296D+00 -0.992230D+00 -0.748548D+00 -0.474248D-01
               116           117           118           119           120 
      1   0.259697D+00 -0.474248D-01  0.334297D+01 -0.692194D+00 -0.218518D+01
      2  -0.944029D+00 -0.716611D-01 -0.692194D+00  0.720719D+00  0.113878D+00
      3  -0.716611D-01 -0.143053D+00 -0.218518D+01  0.113878D+00  0.197980D+01
               121           122           123           124           125 
      1  -0.115273D+01  0.175173D+01  0.765114D-01 -0.646035D+01  0.637108D+00
      2   0.175173D+01 -0.442921D+00 -0.968790D+00  0.637108D+00 -0.125502D+01
      3   0.765114D-01 -0.968790D+00 -0.366013D+00  0.437589D+01 -0.732345D+00
               126           127           128           129           130 
      1   0.437589D+01 -0.829203D+01 -0.767583D+00  0.151568D+01 -0.454495D+01
      2  -0.732345D+00 -0.767583D+00  0.321841D+01 -0.434678D+00  0.334700D+01
      3  -0.985836D+01  0.151568D+01 -0.434678D+00  0.182630D+01 -0.551744D+00
               131           132           133           134           135 
      1   0.334700D+01 -0.551744D+00  0.241710D+01 -0.130845D+01  0.982610D+00
      2   0.292754D+01  0.287275D+01 -0.130845D+01  0.344147D+01  0.878000D+00
      3   0.287275D+01 -0.129542D+00  0.982610D+00  0.878000D+00 -0.670933D+01
               136           137           138           139           140 
      1   0.961116D+01  0.347308D+01 -0.182094D+01  0.295386D+01  0.226776D+01
      2   0.347308D+01  0.199037D+01 -0.651587D+00  0.226776D+01  0.167553D+01
      3  -0.182094D+01 -0.651587D+00  0.130020D+01 -0.637200D+00 -0.776944D+00
               141           142           143           144           145 
      1  -0.637200D+00 -0.434133D+01 -0.153250D+01  0.226314D+01  0.162199D+01
      2  -0.776944D+00 -0.153250D+01 -0.137406D+01  0.902136D+00  0.573471D+00
      3   0.471215D+00  0.226314D+01  0.902136D+00 -0.768394D+00  0.135631D+01
               146           147           148           149           150 
      1   0.573471D+00  0.135631D+01  0.118008D+00  0.495221D+00 -0.195187D+00
      2  -0.246179D-01  0.181777D+00  0.495221D+00 -0.939051D-01  0.682896D+00
      3   0.181777D+00  0.881492D+00 -0.195187D+00  0.682896D+00 -0.470172D+00
               151           152           153           154           155 
      1   0.221936D+01  0.594270D-01  0.307243D+01  0.129553D+01  0.963914D+00
      2   0.594270D-01  0.144005D+01  0.681791D+00  0.963914D+00  0.357928D+00
      3   0.307243D+01  0.681791D+00  0.747504D+01 -0.104032D+01 -0.423796D+00
               156           157           158           159           160 
      1  -0.104032D+01  0.103235D+01  0.204912D+01 -0.727398D+00 -0.320054D+01
      2  -0.423796D+00  0.204912D+01  0.593061D+01 -0.280588D+01 -0.248227D+01
      3   0.404718D+00 -0.727398D+00 -0.280588D+01  0.236359D+01  0.171343D+01
               161           162           163           164           165 
      1  -0.248227D+01  0.171343D+01 -0.394843D+00  0.663254D+00  0.726891D+00
      2  -0.580109D+01  0.533396D+01  0.663254D+00 -0.911558D+00 -0.202222D+00
      3   0.533396D+01 -0.654656D+01  0.726891D+00 -0.202222D+00 -0.205090D+00
               166           167           168           169           170 
      1   0.144702D+01  0.145795D+01  0.217329D+00  0.928060D+00  0.309526D+00
      2   0.145795D+01  0.922768D+01  0.277713D+01  0.309526D+00  0.494247D+01
      3   0.217329D+00  0.277713D+01  0.204937D+01  0.618602D+00  0.368085D+01
               171           172           173           174           175 
      1   0.618602D+00  0.172113D+00  0.814522D-01  0.607652D+00  0.741664D+00
      2   0.368085D+01  0.814522D-01 -0.735337D+00  0.256514D+00 -0.243154D+00
      3   0.195493D+01  0.607652D+00  0.256514D+00 -0.123519D+01  0.133661D+00
               176           177           178           179           180 
      1  -0.243154D+00  0.133661D+00  0.159871D+01 -0.625986D+00  0.730343D+00
      2  -0.574835D+00  0.596949D+00 -0.625986D+00  0.155415D+01 -0.143254D+01
      3   0.596949D+00  0.493970D-01  0.730343D+00 -0.143254D+01  0.768555D+01
               181           182           183           184           185 
      1   0.132776D+02 -0.214375D+01 -0.262394D+00  0.959934D+00  0.840478D+00
      2  -0.214375D+01  0.144276D+01 -0.884374D-01  0.840478D+00 -0.448252D+00
      3  -0.262394D+00 -0.884374D-01  0.104017D+01  0.784831D-01 -0.350687D+00
               186           187           188           189           190 
      1   0.784831D-01 -0.183556D+01  0.389856D+00  0.125997D+01  0.305704D+00
      2  -0.350687D+00  0.389856D+00 -0.787721D+00 -0.294782D+00 -0.560016D+00
      3   0.163539D+00  0.125997D+01 -0.294782D+00  0.112066D+00 -0.475737D+00
               191           192           193           194           195 
      1  -0.560016D+00 -0.475737D+00 -0.134190D+01  0.501629D+00 -0.110588D+00
      2  -0.139389D+01 -0.936097D-01  0.501629D+00 -0.833829D+01 -0.159150D+01
      3  -0.936097D-01 -0.440488D+00 -0.110588D+00 -0.159150D+01 -0.140245D+01
               196           197           198 
      1  -0.119294D+01  0.479604D+00 -0.337911D-01
      2   0.479604D+00 -0.265215D+01 -0.148493D+01
      3  -0.337911D-01 -0.148493D+01 -0.535100D+00
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1  -0.139924D+01 -0.235522D+00 -0.500644D+01  0.116865D+01  0.208568D+00
      2   0.905902D+00  0.119641D+01  0.312570D+01 -0.382003D+00 -0.741891D+00
      3  -0.692111D+01 -0.128622D+02 -0.215054D+00  0.827856D+01 -0.320015D+01
                 6             7             8             9            10 
      1  -0.185222D+01 -0.876618D+01  0.324711D+01  0.152117D+01  0.582775D+00
      2   0.839927D+01 -0.238549D+01  0.125301D+02  0.150680D+01  0.209473D+00
      3   0.293802D+00  0.113804D+01  0.227611D+01 -0.588268D+01  0.461523D+01
                11            12            13            14            15 
      1   0.464985D+00  0.926659D+00  0.126626D+01 -0.141313D+01  0.339897D+01
      2  -0.332663D+00  0.100172D+02 -0.230801D+01 -0.173670D+00 -0.192761D+01
      3  -0.967208D+01 -0.118513D+00  0.133552D+02  0.384223D+01 -0.206654D+01
                16            17            18            19            20 
      1   0.254846D+01  0.126254D+02  0.112881D+01  0.137812D+01 -0.888543D+00
      2   0.953860D+01 -0.365190D+01 -0.345368D+01  0.818209D+00 -0.131562D+00
      3   0.109111D+01 -0.340929D+00  0.247791D+01 -0.346173D+01 -0.159272D+02
                21            22            23            24            25 
      1  -0.658620D+00 -0.119668D+01  0.561640D+00 -0.338793D+01  0.399617D+01
      2  -0.155431D+01  0.103128D+01  0.175262D+01 -0.728314D+01 -0.971950D+01
      3  -0.895562D+00 -0.739783D+00  0.117272D+01 -0.302115D+00  0.118890D+01
                26            27            28            29            30 
      1   0.227707D+01 -0.290035D+00 -0.192960D+01  0.199275D+01 -0.118065D+01
      2  -0.107217D+02 -0.930073D+00 -0.351392D+01 -0.156849D+01 -0.682124D+00
      3   0.108876D+01  0.590089D+01 -0.380242D+01  0.609206D+01  0.173127D+01
                31            32            33            34            35 
      1   0.228524D+01  0.641670D+00 -0.136701D+01 -0.247873D+01  0.664227D+01
      2   0.176912D+01 -0.241625D+01 -0.892406D+00 -0.156507D+02 -0.134177D+01
      3   0.978492D+01  0.230679D+02 -0.139065D+01  0.319244D+01 -0.143136D+01
                36            37            38            39            40 
      1   0.375859D+00  0.915968D+00  0.176142D+01  0.125672D+01  0.248476D+01
      2   0.167953D+01 -0.206883D+01 -0.152504D+01  0.233880D+00 -0.949242D+00
      3   0.333974D+01 -0.912005D+01  0.124600D+02  0.184256D+01  0.109019D+02
                41            42            43            44            45 
      1  -0.116949D+00 -0.687307D+00  0.352772D+01  0.105083D+02 -0.258998D+00
      2   0.353456D+00  0.482393D+00 -0.134023D+02  0.664626D+00  0.124467D+01
      3  -0.737206D+01 -0.145236D+01 -0.783588D+00 -0.615393D+01 -0.247393D+01
                46            47            48            49            50 
      1   0.444806D+00 -0.577482D+00  0.493911D+01 -0.737247D+00 -0.110268D+01
      2  -0.294695D+01  0.214512D+01 -0.296992D+01  0.143014D-02  0.101562D+01
      3   0.105371D+02 -0.332175D+01 -0.261971D+01  0.729725D+01 -0.710907D+01
                51            52            53            54            55 
      1  -0.351572D+01  0.485554D+01  0.867247D+00 -0.206366D+01 -0.156872D+01
      2   0.183411D+01 -0.149318D+02  0.190852D+01  0.222955D+01 -0.447279D+00
      3   0.888727D-01 -0.460234D+01  0.982909D+00 -0.552367D+01 -0.235962D+01
                56            57            58            59            60 
      1   0.219869D+01 -0.150499D+01  0.303196D+01 -0.123365D+01 -0.125473D+01
      2   0.128113D+01 -0.190835D+01  0.155952D+01 -0.617090D+01  0.120437D+01
      3  -0.271623D+01 -0.138373D+01  0.129492D+02  0.807248D+01  0.450818D+01
                61            62            63            64            65 
      1  -0.333264D+01  0.621486D+01  0.349910D+01 -0.358990D+01 -0.117418D+01
      2  -0.109339D+02  0.664311D+00  0.147825D+02  0.762016D+01  0.364966D+01
      3  -0.412296D+01  0.795961D+01  0.198488D+01  0.898276D+01 -0.135886D+02
                66            67            68            69            70 
      1   0.187603D+01 -0.164377D+01 -0.364854D+01 -0.247223D+01  0.446750D+01
      2  -0.211941D+01  0.447556D+01  0.345413D+01  0.585824D+00 -0.127748D+02
      3   0.170866D+01 -0.884055D+01 -0.535238D+01 -0.348100D+01  0.116590D+01
                71            72            73            74            75 
      1   0.188001D+01  0.598481D+01  0.625838D+00 -0.304599D+01  0.675346D-01
      2  -0.158062D+01 -0.131665D+02 -0.131045D+01  0.125441D+01  0.155342D+01
      3  -0.475307D+01 -0.334681D+01 -0.843953D+01  0.846287D+00 -0.138187D+01
                76            77            78            79            80 
      1  -0.841141D+00  0.516915D+01  0.758065D+01  0.642728D+01  0.236798D+02
      2   0.320186D+00  0.539568D+00 -0.268771D+01 -0.572993D+01 -0.623654D+01
      3   0.135822D+02 -0.681073D+01  0.388328D+01 -0.609481D+00  0.838201D+01
                81            82            83            84            85 
      1  -0.704430D+01  0.379362D+00  0.392566D+00 -0.236516D+01 -0.145829D+00
      2   0.309573D+01 -0.773091D+00 -0.781934D+00  0.300078D+01 -0.354768D-01
      3   0.155490D+01 -0.136615D+01 -0.495168D+01  0.282403D+00 -0.371787D+01
                86            87            88            89            90 
      1  -0.509288D-01 -0.324212D+01  0.123554D+01  0.167631D+01  0.430095D-01
      2  -0.186156D+00  0.294435D+01 -0.137540D+01 -0.129301D+01 -0.118843D+00
      3  -0.109473D+02  0.110880D+00 -0.301215D+00 -0.749847D+00  0.357179D+00
                91            92            93            94            95 
      1   0.274207D-01 -0.455443D+00  0.655256D+00 -0.227250D+00  0.145751D+00
      2  -0.217162D+01  0.280074D+00  0.612120D+01  0.765564D+00 -0.457916D+00
      3   0.233407D+01 -0.545090D+01 -0.322182D+00 -0.434025D+01  0.181044D+01
                96            97            98            99           100 
      1  -0.506226D+00 -0.532803D+00  0.343499D+00 -0.853383D-01 -0.949126D-01
      2  -0.915926D+00 -0.284988D+01  0.534398D+00 -0.489751D+00 -0.435033D+00
      3   0.621493D+00 -0.519354D+00  0.689443D+00 -0.171074D+00  0.964509D+00
               101           102           103           104           105 
      1   0.190097D+00  0.158805D+01  0.885242D-01  0.406776D+00 -0.433212D+01
      2   0.648717D+00  0.144506D+01  0.447529D+00 -0.185906D+01 -0.254182D+01
      3  -0.298665D+01 -0.377203D+00 -0.109271D+01  0.153550D+02  0.159087D+01
               106           107           108           109           110 
      1  -0.407907D+00  0.174310D+01 -0.385223D+00  0.231766D+00  0.939991D-02
      2  -0.912142D+00  0.636024D+00 -0.190775D+00  0.619289D+00 -0.710930D+00
      3  -0.264508D+00  0.136870D+01 -0.216320D+00 -0.682309D+01  0.562803D+01
               111           112           113           114           115 
      1   0.116151D+01 -0.297054D+00  0.703838D+00 -0.421407D+01 -0.539132D+00
      2   0.335192D+00 -0.949639D+00  0.973538D+00 -0.390262D+00 -0.108718D+01
      3   0.533298D+00  0.851591D+01 -0.125487D+02 -0.124370D+01  0.107068D+01
               116           117           118           119           120 
      1   0.201946D+01 -0.230933D+00 -0.752745D+00 -0.156558D+01  0.909449D+00
      2   0.253246D+00 -0.203203D+00 -0.129370D+01 -0.190364D-01  0.400864D+01
      3  -0.189405D+01  0.676177D-01 -0.118963D+01 -0.371332D+01  0.129992D+01
               121           122           123           124           125 
      1  -0.141386D+01 -0.597521D+00 -0.113924D+01  0.995703D+00  0.283673D+01
      2   0.343164D+00  0.927777D-01 -0.105393D+01  0.242684D+01 -0.543211D+00
      3  -0.266235D+01 -0.969693D+00  0.205973D+01  0.215859D+01  0.245799D+01
               126           127           128           129           130 
      1  -0.370039D+01  0.283845D+01 -0.243029D-01  0.330642D+01 -0.242631D+01
      2  -0.156978D+02  0.866917D+01 -0.233465D+01  0.617285D+01 -0.309089D+01
      3  -0.363960D+00  0.216595D+02 -0.129783D+02 -0.164886D+01 -0.200977D+01
               131           132           133           134           135 
      1   0.960399D+01 -0.160091D+00 -0.121859D+00  0.478100D+01 -0.107919D+02
      2   0.733042D+01  0.132112D+00 -0.635295D+00  0.318999D+01 -0.171047D+02
      3  -0.185889D+02 -0.814155D+01 -0.114210D+01 -0.803870D+01 -0.480405D+01
               136           137           138           139           140 
      1   0.238487D+01  0.565651D+00 -0.257247D+01  0.756188D+00  0.742524D+00
      2  -0.486313D+01 -0.188689D+01  0.605532D+01 -0.180365D+01 -0.189606D+01
      3   0.489919D+01 -0.415673D+01 -0.986914D+00  0.684694D+00 -0.215098D+01
               141           142           143           144           145 
      1  -0.153035D+01 -0.279718D+01  0.113841D+00  0.121955D+01 -0.109123D+01
      2   0.197276D+01  0.422003D+01  0.196010D+01 -0.272815D+01  0.170944D+01
      3   0.121203D+01 -0.232014D+01  0.306196D+01  0.823711D+00 -0.328969D+00
               146           147           148           149           150 
      1   0.215754D+00 -0.135363D+01  0.246995D+00 -0.129228D+01 -0.340734D+00
      2  -0.286556D+00  0.310523D+01 -0.894154D+00  0.111323D+01 -0.919921D+00
      3  -0.176159D+00  0.133660D+01  0.195592D+01  0.223692D+01 -0.152286D+01
               151           152           153           154           155 
      1  -0.378439D+01  0.277489D+01 -0.874051D+01  0.204702D+01  0.397119D+00
      2   0.313066D+01  0.161143D+01  0.166721D+02  0.478599D+00 -0.346788D+00
      3   0.374803D+01 -0.558377D+01  0.207219D+01  0.458470D+01  0.330404D+00
               156           157           158           159           160 
      1  -0.966885D+00  0.165170D+01  0.392239D+01 -0.691329D+01 -0.396553D+01
      2   0.140526D+01 -0.214448D-01 -0.209578D+01  0.215034D+01 -0.265290D+00
      3  -0.226545D+01  0.175099D+01 -0.329162D+00  0.628070D+00 -0.681515D+01
               161           162           163           164           165 
      1  -0.950168D+01  0.148041D+02 -0.105776D+01  0.686492D+00  0.509924D+00
      2   0.432207D+01 -0.541750D+01  0.186399D+00 -0.350588D+00  0.660710D+00
      3  -0.566654D+00 -0.765366D+00 -0.107114D+01 -0.375428D+00  0.165970D+01
               166           167           168           169           170 
      1  -0.183647D+01 -0.813002D+01 -0.771834D+01 -0.183499D+01 -0.833524D+01
      2  -0.281186D+00  0.238522D+01  0.169821D+01 -0.577673D+00  0.254053D+01
      3   0.496558D+01 -0.469505D+01 -0.225086D+01  0.432508D+01 -0.419844D+01
               171           172           173           174           175 
      1  -0.657517D+01  0.797916D+00 -0.526978D+00 -0.189232D+01 -0.678656D-01
      2   0.131893D+01  0.216184D+01  0.546102D+00 -0.251671D+01  0.303156D+00
      3  -0.219477D+01 -0.288178D+00  0.157542D+01 -0.162442D+01  0.119912D+01
               176           177           178           179           180 
      1   0.107811D+01 -0.116946D+01  0.460541D+00  0.138977D+01  0.137902D+02
      2   0.134398D+01 -0.239033D+00 -0.241221D+01 -0.318519D+01  0.196558D+02
      3   0.167571D+01 -0.142850D+01 -0.149186D+01 -0.366087D+01  0.373014D+01
               181           182           183           184           185 
      1  -0.174185D+00  0.137610D+00  0.207007D+01  0.248980D+00 -0.688919D+00
      2  -0.414308D+01 -0.614775D-01  0.635032D+01  0.217357D+00 -0.986434D+00
      3  -0.183597D+02 -0.467671D+01  0.103215D+01 -0.187537D+01  0.620090D-01
               186           187           188           189           190 
      1  -0.459255D+00  0.143422D+01  0.314376D+00  0.253612D+00 -0.996031D+00
      2   0.546908D+00  0.212893D+01 -0.410838D+00  0.244713D+00 -0.128601D+01
      3   0.109992D+01  0.167620D+01  0.190479D+01 -0.935249D+00  0.393158D+01
               191           192           193           194           195 
      1  -0.518508D+00 -0.176554D+01 -0.521156D+00 -0.560848D+01 -0.598283D+01
      2   0.336595D-01 -0.574292D+00 -0.518166D+00 -0.337046D+01 -0.309889D+01
      3   0.485389D+01  0.171496D+01  0.553966D+01  0.238017D+02  0.530273D+01
               196           197           198 
      1  -0.364695D+00 -0.233024D+01 -0.175574D+01
      2  -0.128397D+01 -0.287340D+01 -0.104908D+01
      3   0.221771D+01  0.719934D+01  0.436872D+01
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1   0.778329D+00 -0.251416D+02 -0.169004D+01  0.305337D+02  0.629572D+01
      2  -0.517346D+01  0.176380D+02 -0.733426D+00 -0.313845D+02 -0.122078D+02
      3   0.439513D+01  0.750354D+01  0.242346D+01  0.850768D+00  0.591204D+01
      4  -0.202719D+02  0.640135D+01  0.547698D+01  0.675836D+01 -0.146127D+02
      5   0.146808D+01  0.601846D+01  0.790916D+01  0.605136D+00 -0.301835D+01
      6   0.507313D+01  0.229467D+01  0.114031D+02 -0.321065D+01  0.629504D+00
                 6             7             8             9            10 
      1   0.917125D+00  0.681811D+01  0.675715D+01  0.198845D+01 -0.967240D+01
      2   0.684774D+00 -0.491201D+01 -0.580369D+01 -0.868111D+01  0.405954D+01
      3  -0.160190D+01 -0.190609D+01 -0.953458D+00  0.669266D+01  0.561286D+01
      4  -0.421053D+01  0.476434D+01 -0.245161D+01  0.176568D+02  0.501571D+01
      5   0.179733D+02  0.251098D+02  0.194352D+02  0.269832D+01  0.106691D+02
      6   0.573708D+01  0.111052D+02  0.166016D+02 -0.241701D+01 -0.102173D+01
                11            12            13            14            15 
      1   0.347181D+01  0.758832D+01 -0.137495D+02 -0.250043D+02 -0.238900D+01
      2  -0.124356D+01 -0.382954D+01  0.119510D+02  0.256915D+02  0.412839D+01
      3  -0.222825D+01 -0.375878D+01  0.179850D+01 -0.687246D+00 -0.173939D+01
      4   0.258422D+02 -0.118516D+01 -0.291689D+02  0.834634D+01  0.322396D+01
      5  -0.183220D+01  0.218056D+02 -0.683412D+01  0.237618D+01 -0.435621D+01
      6  -0.114286D+01 -0.238976D+01  0.260743D+01 -0.119100D+01 -0.788359D+01
                16            17            18            19            20 
      1   0.111283D+02 -0.402692D+01  0.158105D+02  0.125332D+02  0.204653D+02
      2  -0.387928D+01  0.268968D+01 -0.218025D+02 -0.115170D+02 -0.139601D+02
      3  -0.724906D+01  0.133724D+01  0.599200D+01 -0.101618D+01 -0.650528D+01
      4  -0.673593D+01 -0.114405D+01 -0.242257D+01  0.106233D+02 -0.132172D+02
      5   0.387231D+02 -0.414217D+01 -0.718469D+01  0.170107D+01 -0.389231D+01
      6  -0.305019D+00  0.521447D+01 -0.169821D+01 -0.205916D+01  0.576192D+01
                21            22            23            24            25 
      1  -0.109820D+01 -0.238938D+02  0.130882D+02  0.109560D+01  0.314339D+00
      2   0.425925D+00  0.233116D+02 -0.224742D+02 -0.444233D+01  0.177680D+01
      3   0.672280D+00  0.582189D+00  0.938607D+01  0.334673D+01 -0.209114D+01
      4  -0.333270D+01  0.993473D+01  0.406394D+01  0.270573D+01 -0.412130D+01
      5  -0.446937D+01 -0.960939D+00  0.318759D+01 -0.144598D+02  0.119381D+02
      6  -0.906901D-01  0.201094D+01 -0.540744D+01  0.850915D+01 -0.768514D+01
                26            27            28            29            30 
      1  -0.187038D+01 -0.436748D+01 -0.809015D+01 -0.267342D+02 -0.247682D+00
      2  -0.311400D+01 -0.594268D+01  0.721183D+01  0.194518D+02 -0.170723D+01
      3   0.498438D+01  0.103102D+02  0.878325D+00  0.728236D+01  0.195491D+01
      4   0.644543D+01 -0.170014D+02 -0.758010D+01 -0.984374D+01 -0.102999D+01
      5  -0.164779D+02 -0.196143D+01 -0.194811D+01 -0.353667D+00 -0.701483D+00
      6   0.136461D+02  0.248638D+01 -0.118520D+01 -0.456746D+01  0.307234D+01
                31            32            33            34            35 
      1  -0.123260D+02 -0.123613D+02 -0.101567D+01  0.195424D+01  0.237599D+00
      2   0.116592D+01  0.121950D+02  0.358637D+00 -0.261531D+01 -0.396579D+00
      3   0.111601D+02  0.166278D+00  0.657036D+00  0.661072D+00  0.158980D+00
      4   0.548701D+01 -0.750798D+01 -0.252118D+01 -0.175786D+01  0.219988D+01
      5  -0.422785D+01 -0.258797D+01  0.241080D+00  0.157634D+01 -0.345576D+01
      6  -0.833708D+01 -0.224233D+01  0.350255D+01  0.225900D+01  0.107421D+02
                36            37            38            39            40 
      1  -0.125604D+02 -0.236719D+02  0.485329D+01 -0.101738D+01 -0.216662D+01
      2   0.288144D+01  0.732245D+01 -0.432646D+00  0.991986D+00  0.478609D+01
      3   0.967895D+01  0.163494D+02 -0.442064D+01  0.253950D-01 -0.261947D+01
      4  -0.184176D+01 -0.668300D+01  0.904231D+01  0.716822D+00 -0.690135D+01
      5   0.208058D+01 -0.996436D+01 -0.495135D+00  0.307487D+01  0.123674D+01
      6  -0.120012D+01  0.315981D+00 -0.219377D+01 -0.165179D+01  0.549452D+01
                41            42            43            44            45 
      1   0.472765D-01  0.991737D+00  0.478169D+01 -0.230107D+01 -0.802327D+01
      2   0.866134D+01  0.123076D+01 -0.114626D+01  0.222533D+01 -0.278656D+01
      3  -0.870862D+01 -0.222250D+01 -0.363543D+01  0.757370D-01  0.108098D+02
      4   0.602213D+01  0.335074D+01 -0.175193D+01  0.405704D+01 -0.118245D+01
      5   0.225746D+01 -0.148953D+00  0.407710D+01  0.153915D+01  0.270558D+00
      6   0.122056D+01 -0.234389D+00 -0.983742D+00  0.505404D+01  0.107975D+01
                46            47            48            49            50 
      1   0.630636D+01  0.103553D+02 -0.718345D+00  0.184966D+01  0.721943D+01
      2  -0.366080D+01 -0.988937D+01  0.170228D+01  0.682348D+01 -0.153736D+02
      3  -0.264556D+01 -0.465899D+00 -0.983939D+00 -0.867314D+01  0.815418D+01
      4   0.894247D+01 -0.212367D+02 -0.202894D+01  0.160475D+02  0.130829D+02
      5   0.571963D+00 -0.209898D+01 -0.696723D+01  0.212583D+01  0.104561D+01
      6  -0.358620D+01  0.263064D+01 -0.990935D+01  0.847901D+00 -0.494963D+01
                51            52            53            54            55 
      1   0.222038D+01 -0.407944D+00  0.794192D-01 -0.172230D+02  0.192501D+02
      2  -0.385258D+01  0.198338D+01 -0.366075D+01  0.433633D+01 -0.454046D+01
      3   0.163220D+01 -0.157543D+01  0.358133D+01  0.128867D+02 -0.147096D+02
      4   0.557229D+00  0.345851D+01  0.464429D+01  0.707477D+01  0.136545D+02
      5   0.160008D+01  0.108791D+01  0.750522D+01  0.531324D+01  0.642400D+01
      6   0.813980D+01 -0.266100D+01  0.175499D+02  0.551550D+01  0.474728D-01
                56            57            58            59            60 
      1   0.121162D+01 -0.933642D+00  0.550359D+01 -0.905889D+01  0.166004D+01
      2   0.239148D+01 -0.460187D+01 -0.418002D+00  0.384229D+00  0.944626D+00
      3  -0.360310D+01  0.553551D+01 -0.508558D+01  0.867466D+01 -0.260467D+01
      4  -0.134009D+02  0.527098D+00 -0.255947D+02 -0.562815D+01 -0.859276D+01
      5   0.165548D+01 -0.125168D+02  0.246808D+01 -0.868844D+01  0.428242D+01
      6  -0.399728D+01  0.388034D+01 -0.671210D+01  0.330714D+01 -0.294657D+01
                61            62            63            64            65 
      1  -0.137957D+02  0.267822D+01  0.378505D+01 -0.187670D+02 -0.199405D+02
      2  -0.127279D+02  0.393610D+01  0.126687D+02  0.324717D+01  0.109363D+02
      3   0.265236D+02 -0.661432D+01 -0.164538D+02  0.155199D+02  0.900418D+01
      4   0.947724D+00 -0.138955D+02  0.559943D+01 -0.245533D+02 -0.671777D+01
      5  -0.187589D+02  0.350120D+01  0.399290D+02  0.156193D+02  0.569378D+01
      6   0.651068D+01 -0.591450D-01 -0.915704D+01  0.680056D+01  0.337512D+01
                66            67            68            69            70 
      1   0.933158D+01 -0.209720D+02  0.839767D+00  0.179901D+01  0.164290D+02
      2  -0.171178D+01  0.110424D+02  0.196539D+01  0.881169D+00  0.477247D-01
      3  -0.761981D+01  0.992962D+01 -0.280516D+01 -0.268018D+01 -0.164767D+02
      4   0.684016D+01 -0.381575D+01  0.128107D+02  0.718696D+01  0.148971D+02
      5  -0.824681D+01  0.709868D+01  0.603778D+01  0.157387D+01 -0.154938D+02
      6  -0.336755D+01  0.469370D+01  0.648388D+01  0.173435D+01 -0.759347D+01
                71            72            73            74            75 
      1   0.793160D+01 -0.987807D+01 -0.558512D+01  0.121044D+02 -0.470140D+01
      2  -0.265862D+01  0.171556D+02  0.884361D+01 -0.723310D+01  0.496478D+01
      3  -0.527298D+01 -0.727751D+01 -0.325849D+01 -0.487129D+01 -0.263372D+00
      4   0.981179D+01 -0.755194D+01  0.420100D+01  0.391351D+01  0.327757D+00
      5  -0.312591D+01 -0.291861D+02 -0.134785D+01  0.123630D+01 -0.192069D+01
      6   0.387710D+01 -0.105091D+02  0.172051D+01  0.721537D+01 -0.108287D+01
                76            77            78            79            80 
      1   0.266996D+02  0.333349D+02 -0.365015D+00 -0.112786D+02 -0.313245D+01
      2  -0.202220D+02 -0.354584D+02 -0.811754D+01  0.742889D+01 -0.853446D+01
      3  -0.647759D+01  0.212355D+01  0.848255D+01  0.384975D+01  0.116669D+02
      4   0.187627D+01 -0.716981D+01  0.492215D+00  0.727115D+00  0.363145D+01
      5   0.313759D+01  0.142852D+01 -0.714471D+01 -0.229271D+01 -0.111180D+02
      6   0.596298D+01 -0.512599D+01 -0.226718D+02 -0.129538D+02 -0.440279D+02
                81            82            83            84            85 
      1   0.300270D+02  0.259099D+02  0.162522D+02 -0.364997D+00  0.103390D+02
      2  -0.287344D+02 -0.449539D+01  0.944572D+00  0.146381D+00  0.816234D+01
      3  -0.129264D+01 -0.214145D+02 -0.171967D+02  0.218615D+00 -0.185014D+02
      4  -0.851149D+01  0.391707D+02  0.348369D+02 -0.127884D+01  0.389249D+02
      5   0.852819D+01 -0.625944D+00 -0.789420D+00  0.535979D+01  0.750495D+00
      6   0.181142D+02 -0.133905D+01 -0.133235D+01  0.288328D+01 -0.212804D+00
                86            87            88            89            90 
      1   0.487707D+01  0.866917D-01 -0.211397D+01 -0.159514D+01 -0.236875D-01
      2   0.179530D+02 -0.336637D+00  0.114269D+01  0.124997D+01  0.111039D+01
      3  -0.228301D+02  0.249945D+00  0.971280D+00  0.345168D+00 -0.108670D+01
      4   0.478327D+02  0.444338D-01 -0.182709D+01 -0.695801D+00  0.142118D+01
      5   0.939744D+00  0.403074D+01  0.781593D+00  0.920237D-01 -0.536894D+00
      6  -0.558633D+00  0.506445D+01  0.628837D+00  0.114332D+01 -0.791162D-01
                91            92            93            94            95 
      1   0.102936D+03 -0.101067D+02 -0.946165D+01 -0.990957D+01  0.104783D+02
      2  -0.600762D+02  0.554777D+01  0.653846D+01  0.479554D+01 -0.523997D+01
      3  -0.428595D+02  0.455897D+01  0.292319D+01  0.511403D+01 -0.523831D+01
      4  -0.145833D+02  0.947065D+01  0.145532D+01  0.173553D+02 -0.487838D+01
      5  -0.137280D+02  0.146286D+01  0.102105D+02  0.261244D+01 -0.175493D+01
      6   0.262351D+00 -0.679012D+00 -0.655034D+00 -0.127755D+01  0.284258D+00
                96            97            98            99           100 
      1   0.153038D+01 -0.127417D+02  0.164882D+01  0.268601D+01  0.578807D+01
      2  -0.113299D+01  0.772197D+01 -0.850481D+00 -0.140241D+01  0.247240D+01
      3  -0.397394D+00  0.501972D+01 -0.798337D+00 -0.128360D+01 -0.826047D+01
      4  -0.181707D+01  0.308584D+01 -0.135673D+01 -0.789546D+00 -0.184684D+02
      5  -0.122000D+01  0.257559D+01 -0.170266D-01 -0.199789D+01 -0.213913D+01
      6   0.203074D+01 -0.216379D+00  0.787447D+00  0.474130D+00  0.187748D+01
               101           102           103           104           105 
      1  -0.457200D+01 -0.552183D+00  0.363073D+00 -0.146789D+02 -0.155730D+01
      2  -0.429598D+01 -0.393221D-01 -0.109399D+02  0.358391D+02  0.256944D+01
      3   0.886799D+01  0.591505D+00  0.105768D+02 -0.211602D+02 -0.101215D+01
      4   0.224042D+02  0.282608D+01  0.258911D+02 -0.483908D+02 -0.495701D+01
      5   0.243445D+01  0.357256D+01  0.255513D+01 -0.378814D+01 -0.408364D+01
      6  -0.226630D+01 -0.230797D+01 -0.275702D+01  0.671763D+01  0.705452D+01
               106           107           108           109           110 
      1  -0.699474D+00 -0.110697D+01 -0.154703D+01 -0.422541D+01  0.790741D+01
      2  -0.792988D+00  0.330322D+01  0.258396D+01  0.641415D+01 -0.990992D+01
      3   0.149246D+01 -0.219625D+01 -0.103693D+01 -0.218874D+01  0.200250D+01
      4   0.427581D+01 -0.609912D+01 -0.167612D+01 -0.350747D+01  0.795612D+01
      5   0.127374D+01 -0.105948D+01 -0.897034D+00  0.413061D+00 -0.336845D-01
      6  -0.138664D+01  0.315728D+01  0.134328D+01  0.125139D+01 -0.238303D+01
               111           112           113           114           115 
      1   0.159057D+01  0.651025D+01 -0.379576D+02 -0.425333D+01  0.100417D+01
      2  -0.115748D+01 -0.837972D+01  0.532164D+02  0.439020D+01 -0.128017D+01
      3  -0.433089D+00  0.186947D+01 -0.152588D+02 -0.136873D+00  0.276004D+00
      4   0.323568D+00  0.594692D+01  0.291822D+01  0.499538D+00  0.362459D+00
      5   0.125887D+01 -0.151559D+00  0.180318D+01  0.342603D+00  0.455834D+00
      6  -0.139484D+01 -0.129780D+01  0.801853D+01  0.715093D+01 -0.335116D+00
               116           117           118           119           120 
      1  -0.354309D+01 -0.149815D+01  0.610029D+01 -0.937963D+00 -0.415833D+01
      2   0.454713D+01  0.200563D+01 -0.929605D+01  0.259602D+00  0.616577D+01
      3  -0.100404D+01 -0.507483D+00  0.319576D+01  0.678360D+00 -0.200744D+01
      4  -0.461797D+00 -0.148908D+01 -0.460906D+01  0.757789D+01  0.172511D+01
      5  -0.611339D+00 -0.753966D+00 -0.118839D+02  0.114992D+01  0.165795D+02
      6   0.282603D+01  0.131579D+01  0.206552D+01  0.491599D-01 -0.176443D+01
               121           122           123           124           125 
      1  -0.353215D+00 -0.182756D+01 -0.223035D+00 -0.142000D+01 -0.977387D+00
      2  -0.803613D+00 -0.492347D+00  0.316212D+00  0.146147D+02 -0.114415D+01
      3   0.115683D+01  0.231990D+01 -0.931773D-01 -0.131947D+02  0.212154D+01
      4   0.109385D+02 -0.329497D+01 -0.404454D+01  0.508957D+01 -0.629033D+01
      5   0.121644D+00 -0.392135D+01 -0.150322D+01  0.257632D+02 -0.398031D+01
      6  -0.173637D+01  0.841084D+00  0.846096D+01 -0.445071D+01  0.538800D+01
               126           127           128           129           130 
      1  -0.131350D+02 -0.639340D+02  0.102698D+02  0.432407D+01 -0.342426D+01
      2  -0.239590D+02  0.364500D+02 -0.141639D+02 -0.465244D+01 -0.436113D+01
      3   0.370939D+02  0.274840D+02  0.389412D+01  0.328374D+00  0.778539D+01
      4  -0.409680D+01  0.146013D+02  0.154553D+02 -0.383731D+01  0.230896D+02
      5  -0.412418D+02  0.565678D+01 -0.184723D+01  0.922172D+01 -0.447128D+01
      6   0.914282D+01 -0.726891D+01  0.293486D+01 -0.608207D+01  0.489961D+01
               131           132           133           134           135 
      1   0.248181D+02  0.541593D+01  0.107235D+02  0.262462D+01  0.165450D+02
      2  -0.277989D+02 -0.117933D+02 -0.131176D+01 -0.130488D+02  0.274379D+00
      3   0.298085D+01  0.637733D+01 -0.941179D+01  0.104242D+02 -0.168194D+02
      4   0.376372D+01  0.133722D+02 -0.108138D+02  0.157800D+02 -0.231922D+01
      5   0.158801D+02 -0.142473D+00  0.710678D+01  0.226683D+01 -0.282702D+02
      6  -0.141389D+02  0.268030D+00 -0.421082D+01 -0.174260D+01  0.186787D+02
               136           137           138           139           140 
      1   0.511113D+02  0.149208D+02 -0.953188D+01  0.111662D+02  0.580045D+01
      2  -0.229774D+02 -0.369285D+01  0.424333D+01 -0.113530D+01  0.290993D+01
      3  -0.281339D+02 -0.112280D+02  0.528855D+01 -0.100309D+02 -0.871038D+01
      4   0.361379D+02  0.208854D+02 -0.688512D+01  0.208462D+02  0.141650D+02
      5  -0.142325D+02 -0.463949D+01  0.109567D+02 -0.434025D+01 -0.513189D+01
      6  -0.592849D+01 -0.298959D+01  0.441771D+01 -0.330096D+01 -0.314537D+01
               141           142           143           144           145 
      1  -0.162846D+01 -0.163530D+02 -0.336501D+01  0.731700D+01  0.729758D+01
      2  -0.640687D+00  0.859175D+01  0.870491D-01 -0.622814D+01 -0.629025D+01
      3   0.226914D+01  0.776120D+01  0.327796D+01 -0.108886D+01 -0.100734D+01
      4  -0.563040D+01 -0.132775D+02 -0.998219D+01  0.822778D+01  0.555056D+01
      5   0.339542D+01  0.159476D+02  0.609493D+01 -0.710929D+01  0.822663D+01
      6   0.327966D+01  0.732457D+01  0.407652D+01 -0.357551D+01  0.243041D+01
               146           147           148           149           150 
      1   0.388800D+01  0.466614D+01  0.202050D+00 -0.115475D+01 -0.156247D+01
      2  -0.228738D+01 -0.485751D+01  0.164035D+01 -0.113478D+01  0.229539D+01
      3  -0.160063D+01  0.191373D+00 -0.184240D+01  0.228953D+01 -0.732917D+00
      4   0.261396D+01  0.226692D+01  0.400349D+01 -0.770496D+00  0.360740D+01
      5   0.694172D+00  0.943100D+01 -0.150746D+01  0.340668D+01 -0.259290D+01
      6   0.117699D+01  0.163704D+01  0.131899D+01  0.865931D+00  0.499892D+01
               151           152           153           154           155 
      1   0.836546D+01 -0.215283D+01 -0.141584D+01  0.767251D+00  0.351466D+00
      2  -0.118942D+02  0.156187D+01 -0.193319D+02 -0.145334D+01 -0.176860D+00
      3   0.352875D+01  0.590963D+00  0.207477D+02  0.686091D+00 -0.174606D+00
      4   0.506035D+01  0.785680D+01  0.720600D+01  0.380153D+01  0.768948D+01
      5   0.189793D+02  0.380702D+01  0.356437D+02 -0.235660D+01 -0.398208D+01
      6   0.671623D+01  0.468928D+01  0.157178D+02 -0.630876D+01 -0.232550D+01
               156           157           158           159           160 
      1  -0.336291D+00 -0.603360D+01 -0.251311D+02  0.120322D+02  0.543927D+01
      2  -0.334600D+00  0.709141D+01  0.287260D+02 -0.109683D+02 -0.377879D+01
      3   0.670891D+00 -0.105781D+01 -0.359494D+01 -0.106388D+01 -0.166048D+01
      4  -0.549360D+01  0.585005D+01  0.916229D+01 -0.451909D+01 -0.101225D+02
      5   0.683289D+01 -0.253618D+01 -0.522430D+01  0.468036D+01  0.778106D+01
      6   0.228849D+01 -0.498924D+01 -0.192202D+02  0.186120D+02  0.111424D+02
               161           162           163           164           165 
      1   0.247514D+02 -0.272664D+02 -0.243558D+00  0.442232D+01  0.228416D+01
      2  -0.194861D+02  0.135817D+02  0.227651D+01 -0.517050D+01 -0.189450D+01
      3  -0.526532D+01  0.136848D+02 -0.203295D+01  0.748176D+00 -0.389652D+00
      4  -0.103862D+02  0.815360D+01  0.126881D+01  0.792122D+01  0.365037D+01
      5   0.107901D+02 -0.121605D+02  0.106713D+01  0.184904D+01  0.260265D+01
      6   0.354286D+02 -0.362303D+02  0.451697D+01 -0.144324D+01 -0.808307D+00
               166           167           168           169           170 
      1  -0.362804D+01 -0.374258D+02 -0.111119D+02  0.232229D+00 -0.203320D+02
      2   0.538138D+01  0.540488D+02  0.164959D+02  0.166286D+01  0.270073D+02
      3  -0.175334D+01 -0.166229D+02 -0.538402D+01 -0.189509D+01 -0.667535D+01
      4   0.677523D+01  0.108263D+02  0.321708D+01  0.520072D+01  0.576621D+01
      5   0.164524D+01  0.380080D+01  0.341707D+01  0.369382D+01  0.556518D+01
      6   0.219299D+01  0.223818D+02  0.161437D+02  0.467202D+01  0.265155D+02
               171           172           173           174           175 
      1  -0.164752D+02  0.394889D+01 -0.273826D+01  0.571854D+01  0.981062D+00
      2   0.154509D+02 -0.391752D+01  0.304669D+01 -0.886560D+00 -0.116797D+01
      3   0.102425D+01 -0.313727D-01 -0.308427D+00 -0.483198D+01  0.186911D+00
      4   0.448162D+01 -0.487474D+00 -0.208775D+01 -0.164574D+01 -0.426992D+00
      5   0.217317D+01  0.189884D+01  0.163663D+00 -0.839338D+00  0.886749D+00
      6   0.146387D+02 -0.149718D+01 -0.176060D+01  0.356992D+01 -0.805099D-01
               176           177           178           179           180 
      1  -0.579458D+01  0.217205D+01  0.659904D+01  0.377643D+01 -0.181611D+02
      2   0.440006D+01 -0.242194D+01 -0.394382D+01 -0.260598D+01 -0.935370D+01
      3   0.139453D+01  0.249890D+00 -0.265522D+01 -0.117045D+01  0.275148D+02
      4  -0.150038D+01  0.214630D+01 -0.717126D+01  0.782221D+01 -0.323933D+01
      5   0.173587D+01  0.113370D-01  0.779085D+01 -0.634220D+01  0.335128D+02
      6  -0.198134D+01  0.601843D+01 -0.209356D+01  0.918746D+01 -0.261094D+02
               181           182           183           184           185 
      1   0.895454D+02 -0.924637D+01 -0.345009D+01  0.654037D+01  0.376863D+01
      2  -0.460519D+02  0.130297D+01  0.146653D+01 -0.632732D+01  0.909471D+00
      3  -0.434934D+02  0.794339D+01  0.198356D+01 -0.213047D+00 -0.467810D+01
      4  -0.384712D+02  0.166045D+02  0.734140D+00  0.813061D+01 -0.368925D+01
      5   0.223165D+01 -0.560733D+00  0.105771D+02  0.533592D+00 -0.161480D+01
      6   0.183068D+01  0.976443D+00 -0.419075D+01  0.308129D+00  0.110714D+01
               186           187           188           189           190 
      1  -0.721252D+00 -0.817075D+01 -0.130132D+00  0.589388D+01  0.320322D+01
      2   0.122696D+01  0.446358D+01  0.190549D+01 -0.498898D+01  0.509151D+00
      3  -0.505705D+00  0.370717D+01 -0.177536D+01 -0.904897D+00 -0.371237D+01
      4  -0.171143D+01  0.451496D+01 -0.393873D+01 -0.307848D+01 -0.171128D+01
      5   0.984262D+00  0.117928D+02 -0.196757D+01 -0.489519D+00 -0.147031D+01
      6   0.767212D+00 -0.341565D+01  0.198962D+01 -0.691481D+00  0.200224D+01
               191           192           193           194           195 
      1  -0.833427D+01 -0.224014D+01 -0.559282D+01 -0.278624D+02 -0.602658D+01
      2   0.957597D+01  0.226026D+01  0.170973D+01  0.486588D+02  0.100495D+02
      3  -0.124171D+01 -0.201232D-01  0.388309D+01 -0.207963D+02 -0.402288D+01
      4  -0.576749D+00  0.124629D+01  0.901659D+01 -0.335101D+02 -0.614893D+01
      5  -0.433971D+00 -0.120327D+01 -0.747717D+00 -0.816937D+01 -0.688064D+01
      6   0.665822D+00  0.254316D+01 -0.174267D+00  0.750249D+01  0.879190D+01
               196           197           198 
      1  -0.430892D+01 -0.688475D+01 -0.749687D+01
      2   0.134758D+01  0.118576D+02  0.614354D+01
      3   0.296134D+01 -0.497289D+01  0.135333D+01
      4   0.519459D+01 -0.113130D+02 -0.462099D+01
      5   0.105557D+01 -0.625781D+01 -0.210948D+01
      6  -0.264620D-01  0.948956D+01  0.455946D+01
 Leave Link  716 at Thu Jul  8 18:49:04 2021, MaxMem= 10737418240 cpu:               1.3 elap:               0.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l9999.exe)
 AllDun F.D. properties on file 20721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) frequency  1    0.085645:
                 1             2             3 
      1   0.150965D+03  0.204140D+01 -0.374916D+01
      2   0.204140D+01  0.131534D+03  0.139921D+01
      3  -0.374916D+01  0.139921D+01  0.825280D+02
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.085645:
                 1             2             3 
      1   0.594273D+00  0.118599D+01  0.225830D+01
      2   0.109170D+02 -0.625041D+01  0.124606D+02
      3   0.846427D+00  0.345263D+02  0.557830D+01
 Property number 4 -- D-Q polarizability frequency  1    0.085645:
                 1             2             3 
      1  -0.785182D+02 -0.170177D+02  0.145421D+02
      2   0.415405D+02  0.297206D+01 -0.144033D+02
      3   0.369777D+02  0.140457D+02 -0.138853D+00
      4  -0.294998D+02 -0.338898D+02 -0.114866D+02
      5   0.145997D+02 -0.148645D+02  0.321895D+02
      6  -0.817230D+01 -0.159724D+01  0.220771D+00
 AllDun F.D. properties on file 20722 Mask=       B NFrqRd=     1 NDeriv=    66 ND12= 1 LenFil=    2379:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1   0.127564D+01 -0.116500D+01 -0.948715D+00 -0.665283D+01 -0.248537D+00
      2  -0.116500D+01 -0.295529D+01 -0.787586D+00 -0.248537D+00 -0.237876D+01
      3  -0.948715D+00 -0.787586D+00 -0.160034D+01  0.751143D+00  0.618032D+00
                 6             7             8             9            10 
      1   0.751143D+00 -0.152872D+01 -0.128048D+00 -0.376598D+01 -0.566647D+01
      2   0.618032D+00 -0.128048D+00  0.530581D+00 -0.409651D+01  0.991047D+00
      3  -0.319970D+01 -0.376598D+01 -0.409651D+01 -0.331748D-01 -0.588161D+00
                11            12            13            14            15 
      1   0.991047D+00 -0.588161D+00  0.249612D+01  0.309202D+01  0.174735D+00
      2  -0.292805D+01 -0.241269D-01  0.309202D+01  0.245064D+01 -0.513259D+00
      3  -0.241269D-01 -0.318951D+01  0.174735D+00 -0.513259D+00  0.112432D+01
                16            17            18            19            20 
      1  -0.593364D+00  0.674284D+00 -0.573666D+01  0.132353D+01 -0.360782D+01
      2   0.674284D+00  0.324373D+00  0.773644D+00 -0.360782D+01 -0.393758D+01
      3  -0.573666D+01  0.773644D+00  0.154573D+01 -0.211839D+00  0.565614D+00
                21            22            23            24            25 
      1  -0.211839D+00  0.580245D+01 -0.677072D+00 -0.125964D+00  0.467603D+00
      2   0.565614D+00 -0.677072D+00  0.598920D+00 -0.505932D+00  0.992523D+00
      3  -0.413817D+00 -0.125964D+00 -0.505932D+00  0.270711D+01 -0.249238D+01
                26            27            28            29            30 
      1   0.992523D+00 -0.249238D+01  0.796982D+00  0.317735D+01 -0.400052D+00
      2  -0.515374D+00  0.372381D+01  0.317735D+01  0.762872D+01 -0.222389D+00
      3   0.372381D+01  0.156349D+01 -0.400052D+00 -0.222389D+00  0.191219D+01
                31            32            33            34            35 
      1   0.134786D+02  0.465664D+01 -0.120510D+01  0.176140D+01 -0.365044D+00
      2   0.465664D+01  0.730059D+01 -0.680353D+00 -0.365044D+00 -0.328726D+00
      3  -0.120510D+01 -0.680353D+00  0.166664D+01  0.154604D+01  0.302788D+01
                36            37            38            39            40 
      1   0.154604D+01  0.174812D+02 -0.197256D+01 -0.239433D+01 -0.661500D+01
      2   0.302788D+01 -0.197256D+01  0.413059D+01  0.299662D-01 -0.343213D+01
      3   0.179385D-03 -0.239433D+01  0.299662D-01  0.252358D+01  0.467922D-01
                41            42            43            44            45 
      1  -0.343213D+01  0.467922D-01 -0.178052D+01 -0.553224D+00  0.323398D+01
      2  -0.632675D+00  0.583718D+00 -0.553224D+00  0.339965D+00 -0.815085D+00
      3   0.583718D+00  0.296712D+00  0.323398D+01 -0.815085D+00 -0.140092D+01
                46            47            48            49            50 
      1  -0.260087D+01  0.383307D+01  0.442648D+00 -0.659575D+01  0.702274D+00
      2   0.383307D+01  0.264658D+01 -0.312948D+00  0.702274D+00 -0.215022D+01
      3   0.442648D+00 -0.312948D+00  0.112382D+01  0.261925D+00  0.459441D+00
                51            52            53            54            55 
      1   0.261925D+00  0.190317D+00 -0.404297D+00  0.410406D+00 -0.556144D+01
      2   0.459441D+00 -0.404297D+00  0.498723D-01 -0.424017D+01  0.291094D+01
      3  -0.245034D+01  0.410406D+00 -0.424017D+01 -0.130089D+01  0.149990D+01
                56            57            58            59            60 
      1   0.291094D+01  0.149990D+01  0.348248D+01 -0.381221D+01  0.293605D+00
      2  -0.253986D+01  0.300866D+00 -0.381221D+01 -0.211327D+01 -0.170092D+01
      3   0.300866D+00 -0.257384D+01  0.293605D+00 -0.170092D+01  0.833074D+00
                61            62            63            64            65 
      1   0.407268D+01  0.185588D+00 -0.369680D+01 -0.485762D+01 -0.413112D+01
      2   0.185588D+00 -0.239108D+01  0.344757D+00 -0.413112D+01  0.137255D+01
      3  -0.369680D+01  0.344757D+00  0.957583D+01  0.229759D+01  0.746061D+00
                66            67            68            69            70 
      1   0.229759D+01 -0.396510D+01  0.681649D+00  0.979761D+00  0.410571D+01
      2   0.746061D+00  0.681649D+00  0.272460D+01  0.141556D+01  0.190806D+01
      3  -0.149754D+01  0.979761D+00  0.141556D+01  0.516778D+00 -0.278087D+01
                71            72            73            74            75 
      1   0.190806D+01 -0.278087D+01 -0.263896D+01  0.536084D+00 -0.535756D-01
      2   0.172016D+01  0.821190D-01  0.536084D+00 -0.273931D+01  0.111180D+01
      3   0.821190D-01 -0.659399D+01 -0.535756D-01  0.111180D+01 -0.244603D+00
                76            77            78            79            80 
      1  -0.164418D+00 -0.450552D+01  0.117693D+01  0.974023D+00  0.221166D+01
      2  -0.450552D+01 -0.919360D+01 -0.338313D+00  0.221166D+01  0.394732D+00
      3   0.117693D+01 -0.338313D+00 -0.388554D+01 -0.165720D+01 -0.658772D+01
                81            82            83            84            85 
      1  -0.165720D+01 -0.580286D+01 -0.440530D+01  0.222616D+00 -0.419067D+01
      2  -0.658772D+01 -0.440530D+01 -0.378822D+01  0.192987D+00 -0.495672D+01
      3   0.383695D+01  0.222616D+00  0.192987D+00 -0.458725D+00 -0.501283D-01
                86            87            88            89            90 
      1  -0.495672D+01 -0.501283D-01  0.358603D+00  0.178363D+00  0.124226D+00
      2  -0.680346D+01 -0.635646D-02  0.178363D+00 -0.386215D-01  0.122062D+00
      3  -0.635646D-02 -0.537197D+00  0.124226D+00  0.122062D+00  0.419045D-02
                91            92            93            94            95 
      1  -0.137150D+02  0.140153D+01  0.148866D+01  0.155048D+01 -0.183144D+01
      2   0.140153D+01 -0.783156D+00 -0.168866D+00 -0.183144D+01  0.518129D+00
      3   0.148866D+01 -0.168866D+00 -0.867938D+00 -0.311558D+00  0.210970D+00
                96            97            98            99           100 
      1  -0.311558D+00  0.172130D+01 -0.328033D+00 -0.100880D-01 -0.226355D+01
      2   0.210970D+00 -0.328033D+00  0.176184D+00  0.303757D-01  0.253319D+01
      3   0.152733D+00 -0.100880D-01  0.303757D-01  0.798595D-01  0.366990D+00
               101           102           103           104           105 
      1   0.253319D+01  0.366990D+00  0.239694D+01 -0.391256D+01 -0.416308D+00
      2  -0.279341D+01 -0.415273D+00 -0.391256D+01  0.940551D+01  0.101370D+01
      3  -0.415273D+00 -0.394341D+00 -0.416308D+00  0.101370D+01  0.795023D+00
               106           107           108           109           110 
      1   0.331093D+00 -0.557846D+00 -0.109890D+00  0.128911D+01 -0.169305D+01
      2  -0.557846D+00  0.117387D+01  0.174355D+00 -0.169305D+01  0.202166D+01
      3  -0.109890D+00  0.174355D+00  0.559529D-01 -0.143697D+00  0.326053D+00
               111           112           113           114           115 
      1  -0.143697D+00 -0.123656D+01  0.177586D+01  0.140296D+00 -0.212660D+00
      2   0.326053D+00  0.177586D+01 -0.958957D+01 -0.992230D+00  0.259697D+00
      3   0.129134D+00  0.140296D+00 -0.992230D+00 -0.748548D+00 -0.474248D-01
               116           117           118           119           120 
      1   0.259697D+00 -0.474248D-01  0.334297D+01 -0.692194D+00 -0.218518D+01
      2  -0.944029D+00 -0.716611D-01 -0.692194D+00  0.720719D+00  0.113878D+00
      3  -0.716611D-01 -0.143053D+00 -0.218518D+01  0.113878D+00  0.197980D+01
               121           122           123           124           125 
      1  -0.115273D+01  0.175173D+01  0.765114D-01 -0.646035D+01  0.637108D+00
      2   0.175173D+01 -0.442921D+00 -0.968790D+00  0.637108D+00 -0.125502D+01
      3   0.765114D-01 -0.968790D+00 -0.366013D+00  0.437589D+01 -0.732345D+00
               126           127           128           129           130 
      1   0.437589D+01 -0.829203D+01 -0.767583D+00  0.151568D+01 -0.454495D+01
      2  -0.732345D+00 -0.767583D+00  0.321841D+01 -0.434678D+00  0.334700D+01
      3  -0.985836D+01  0.151568D+01 -0.434678D+00  0.182630D+01 -0.551744D+00
               131           132           133           134           135 
      1   0.334700D+01 -0.551744D+00  0.241710D+01 -0.130845D+01  0.982610D+00
      2   0.292754D+01  0.287275D+01 -0.130845D+01  0.344147D+01  0.878000D+00
      3   0.287275D+01 -0.129542D+00  0.982610D+00  0.878000D+00 -0.670933D+01
               136           137           138           139           140 
      1   0.961116D+01  0.347308D+01 -0.182094D+01  0.295386D+01  0.226776D+01
      2   0.347308D+01  0.199037D+01 -0.651587D+00  0.226776D+01  0.167553D+01
      3  -0.182094D+01 -0.651587D+00  0.130020D+01 -0.637200D+00 -0.776944D+00
               141           142           143           144           145 
      1  -0.637200D+00 -0.434133D+01 -0.153250D+01  0.226314D+01  0.162199D+01
      2  -0.776944D+00 -0.153250D+01 -0.137406D+01  0.902136D+00  0.573471D+00
      3   0.471215D+00  0.226314D+01  0.902136D+00 -0.768394D+00  0.135631D+01
               146           147           148           149           150 
      1   0.573471D+00  0.135631D+01  0.118008D+00  0.495221D+00 -0.195187D+00
      2  -0.246179D-01  0.181777D+00  0.495221D+00 -0.939051D-01  0.682896D+00
      3   0.181777D+00  0.881492D+00 -0.195187D+00  0.682896D+00 -0.470172D+00
               151           152           153           154           155 
      1   0.221936D+01  0.594270D-01  0.307243D+01  0.129553D+01  0.963914D+00
      2   0.594270D-01  0.144005D+01  0.681791D+00  0.963914D+00  0.357928D+00
      3   0.307243D+01  0.681791D+00  0.747504D+01 -0.104032D+01 -0.423796D+00
               156           157           158           159           160 
      1  -0.104032D+01  0.103235D+01  0.204912D+01 -0.727398D+00 -0.320054D+01
      2  -0.423796D+00  0.204912D+01  0.593061D+01 -0.280588D+01 -0.248227D+01
      3   0.404718D+00 -0.727398D+00 -0.280588D+01  0.236359D+01  0.171343D+01
               161           162           163           164           165 
      1  -0.248227D+01  0.171343D+01 -0.394843D+00  0.663254D+00  0.726891D+00
      2  -0.580109D+01  0.533396D+01  0.663254D+00 -0.911558D+00 -0.202222D+00
      3   0.533396D+01 -0.654656D+01  0.726891D+00 -0.202222D+00 -0.205090D+00
               166           167           168           169           170 
      1   0.144702D+01  0.145795D+01  0.217329D+00  0.928060D+00  0.309526D+00
      2   0.145795D+01  0.922768D+01  0.277713D+01  0.309526D+00  0.494247D+01
      3   0.217329D+00  0.277713D+01  0.204937D+01  0.618602D+00  0.368085D+01
               171           172           173           174           175 
      1   0.618602D+00  0.172113D+00  0.814522D-01  0.607652D+00  0.741664D+00
      2   0.368085D+01  0.814522D-01 -0.735337D+00  0.256514D+00 -0.243154D+00
      3   0.195493D+01  0.607652D+00  0.256514D+00 -0.123519D+01  0.133661D+00
               176           177           178           179           180 
      1  -0.243154D+00  0.133661D+00  0.159871D+01 -0.625986D+00  0.730343D+00
      2  -0.574835D+00  0.596949D+00 -0.625986D+00  0.155415D+01 -0.143254D+01
      3   0.596949D+00  0.493970D-01  0.730343D+00 -0.143254D+01  0.768555D+01
               181           182           183           184           185 
      1   0.132776D+02 -0.214375D+01 -0.262394D+00  0.959934D+00  0.840478D+00
      2  -0.214375D+01  0.144276D+01 -0.884374D-01  0.840478D+00 -0.448252D+00
      3  -0.262394D+00 -0.884374D-01  0.104017D+01  0.784831D-01 -0.350687D+00
               186           187           188           189           190 
      1   0.784831D-01 -0.183556D+01  0.389856D+00  0.125997D+01  0.305704D+00
      2  -0.350687D+00  0.389856D+00 -0.787721D+00 -0.294782D+00 -0.560016D+00
      3   0.163539D+00  0.125997D+01 -0.294782D+00  0.112066D+00 -0.475737D+00
               191           192           193           194           195 
      1  -0.560016D+00 -0.475737D+00 -0.134190D+01  0.501629D+00 -0.110588D+00
      2  -0.139389D+01 -0.936097D-01  0.501629D+00 -0.833829D+01 -0.159150D+01
      3  -0.936097D-01 -0.440488D+00 -0.110588D+00 -0.159150D+01 -0.140245D+01
               196           197           198 
      1  -0.119294D+01  0.479604D+00 -0.337911D-01
      2   0.479604D+00 -0.265215D+01 -0.148493D+01
      3  -0.337911D-01 -0.148493D+01 -0.535100D+00
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1  -0.139924D+01 -0.235522D+00 -0.500644D+01  0.116865D+01  0.208568D+00
      2   0.905902D+00  0.119641D+01  0.312570D+01 -0.382003D+00 -0.741891D+00
      3  -0.692111D+01 -0.128622D+02 -0.215054D+00  0.827856D+01 -0.320015D+01
                 6             7             8             9            10 
      1  -0.185222D+01 -0.876618D+01  0.324711D+01  0.152117D+01  0.582775D+00
      2   0.839927D+01 -0.238549D+01  0.125301D+02  0.150680D+01  0.209473D+00
      3   0.293802D+00  0.113804D+01  0.227611D+01 -0.588268D+01  0.461523D+01
                11            12            13            14            15 
      1   0.464985D+00  0.926659D+00  0.126626D+01 -0.141313D+01  0.339897D+01
      2  -0.332663D+00  0.100172D+02 -0.230801D+01 -0.173670D+00 -0.192761D+01
      3  -0.967208D+01 -0.118513D+00  0.133552D+02  0.384223D+01 -0.206654D+01
                16            17            18            19            20 
      1   0.254846D+01  0.126254D+02  0.112881D+01  0.137812D+01 -0.888543D+00
      2   0.953860D+01 -0.365190D+01 -0.345368D+01  0.818209D+00 -0.131562D+00
      3   0.109111D+01 -0.340929D+00  0.247791D+01 -0.346173D+01 -0.159272D+02
                21            22            23            24            25 
      1  -0.658620D+00 -0.119668D+01  0.561640D+00 -0.338793D+01  0.399617D+01
      2  -0.155431D+01  0.103128D+01  0.175262D+01 -0.728314D+01 -0.971950D+01
      3  -0.895562D+00 -0.739783D+00  0.117272D+01 -0.302115D+00  0.118890D+01
                26            27            28            29            30 
      1   0.227707D+01 -0.290035D+00 -0.192960D+01  0.199275D+01 -0.118065D+01
      2  -0.107217D+02 -0.930073D+00 -0.351392D+01 -0.156849D+01 -0.682124D+00
      3   0.108876D+01  0.590089D+01 -0.380242D+01  0.609206D+01  0.173127D+01
                31            32            33            34            35 
      1   0.228524D+01  0.641670D+00 -0.136701D+01 -0.247873D+01  0.664227D+01
      2   0.176912D+01 -0.241625D+01 -0.892406D+00 -0.156507D+02 -0.134177D+01
      3   0.978492D+01  0.230679D+02 -0.139065D+01  0.319244D+01 -0.143136D+01
                36            37            38            39            40 
      1   0.375859D+00  0.915968D+00  0.176142D+01  0.125672D+01  0.248476D+01
      2   0.167953D+01 -0.206883D+01 -0.152504D+01  0.233880D+00 -0.949242D+00
      3   0.333974D+01 -0.912005D+01  0.124600D+02  0.184256D+01  0.109019D+02
                41            42            43            44            45 
      1  -0.116949D+00 -0.687307D+00  0.352772D+01  0.105083D+02 -0.258998D+00
      2   0.353456D+00  0.482393D+00 -0.134023D+02  0.664626D+00  0.124467D+01
      3  -0.737206D+01 -0.145236D+01 -0.783588D+00 -0.615393D+01 -0.247393D+01
                46            47            48            49            50 
      1   0.444806D+00 -0.577482D+00  0.493911D+01 -0.737247D+00 -0.110268D+01
      2  -0.294695D+01  0.214512D+01 -0.296992D+01  0.143014D-02  0.101562D+01
      3   0.105371D+02 -0.332175D+01 -0.261971D+01  0.729725D+01 -0.710907D+01
                51            52            53            54            55 
      1  -0.351572D+01  0.485554D+01  0.867247D+00 -0.206366D+01 -0.156872D+01
      2   0.183411D+01 -0.149318D+02  0.190852D+01  0.222955D+01 -0.447279D+00
      3   0.888727D-01 -0.460234D+01  0.982909D+00 -0.552367D+01 -0.235962D+01
                56            57            58            59            60 
      1   0.219869D+01 -0.150499D+01  0.303196D+01 -0.123365D+01 -0.125473D+01
      2   0.128113D+01 -0.190835D+01  0.155952D+01 -0.617090D+01  0.120437D+01
      3  -0.271623D+01 -0.138373D+01  0.129492D+02  0.807248D+01  0.450818D+01
                61            62            63            64            65 
      1  -0.333264D+01  0.621486D+01  0.349910D+01 -0.358990D+01 -0.117418D+01
      2  -0.109339D+02  0.664311D+00  0.147825D+02  0.762016D+01  0.364966D+01
      3  -0.412296D+01  0.795961D+01  0.198488D+01  0.898276D+01 -0.135886D+02
                66            67            68            69            70 
      1   0.187603D+01 -0.164377D+01 -0.364854D+01 -0.247223D+01  0.446750D+01
      2  -0.211941D+01  0.447556D+01  0.345413D+01  0.585824D+00 -0.127748D+02
      3   0.170866D+01 -0.884055D+01 -0.535238D+01 -0.348100D+01  0.116590D+01
                71            72            73            74            75 
      1   0.188001D+01  0.598481D+01  0.625838D+00 -0.304599D+01  0.675346D-01
      2  -0.158062D+01 -0.131665D+02 -0.131045D+01  0.125441D+01  0.155342D+01
      3  -0.475307D+01 -0.334681D+01 -0.843953D+01  0.846287D+00 -0.138187D+01
                76            77            78            79            80 
      1  -0.841141D+00  0.516915D+01  0.758065D+01  0.642728D+01  0.236798D+02
      2   0.320186D+00  0.539568D+00 -0.268771D+01 -0.572993D+01 -0.623654D+01
      3   0.135822D+02 -0.681073D+01  0.388328D+01 -0.609481D+00  0.838201D+01
                81            82            83            84            85 
      1  -0.704430D+01  0.379362D+00  0.392566D+00 -0.236516D+01 -0.145829D+00
      2   0.309573D+01 -0.773091D+00 -0.781934D+00  0.300078D+01 -0.354768D-01
      3   0.155490D+01 -0.136615D+01 -0.495168D+01  0.282403D+00 -0.371787D+01
                86            87            88            89            90 
      1  -0.509288D-01 -0.324212D+01  0.123554D+01  0.167631D+01  0.430095D-01
      2  -0.186156D+00  0.294435D+01 -0.137540D+01 -0.129301D+01 -0.118843D+00
      3  -0.109473D+02  0.110880D+00 -0.301215D+00 -0.749847D+00  0.357179D+00
                91            92            93            94            95 
      1   0.274207D-01 -0.455443D+00  0.655256D+00 -0.227250D+00  0.145751D+00
      2  -0.217162D+01  0.280074D+00  0.612120D+01  0.765564D+00 -0.457916D+00
      3   0.233407D+01 -0.545090D+01 -0.322182D+00 -0.434025D+01  0.181044D+01
                96            97            98            99           100 
      1  -0.506226D+00 -0.532803D+00  0.343499D+00 -0.853383D-01 -0.949126D-01
      2  -0.915926D+00 -0.284988D+01  0.534398D+00 -0.489751D+00 -0.435033D+00
      3   0.621493D+00 -0.519354D+00  0.689443D+00 -0.171074D+00  0.964509D+00
               101           102           103           104           105 
      1   0.190097D+00  0.158805D+01  0.885242D-01  0.406776D+00 -0.433212D+01
      2   0.648717D+00  0.144506D+01  0.447529D+00 -0.185906D+01 -0.254182D+01
      3  -0.298665D+01 -0.377203D+00 -0.109271D+01  0.153550D+02  0.159087D+01
               106           107           108           109           110 
      1  -0.407907D+00  0.174310D+01 -0.385223D+00  0.231766D+00  0.939991D-02
      2  -0.912142D+00  0.636024D+00 -0.190775D+00  0.619289D+00 -0.710930D+00
      3  -0.264508D+00  0.136870D+01 -0.216320D+00 -0.682309D+01  0.562803D+01
               111           112           113           114           115 
      1   0.116151D+01 -0.297054D+00  0.703838D+00 -0.421407D+01 -0.539132D+00
      2   0.335192D+00 -0.949639D+00  0.973538D+00 -0.390262D+00 -0.108718D+01
      3   0.533298D+00  0.851591D+01 -0.125487D+02 -0.124370D+01  0.107068D+01
               116           117           118           119           120 
      1   0.201946D+01 -0.230933D+00 -0.752745D+00 -0.156558D+01  0.909449D+00
      2   0.253246D+00 -0.203203D+00 -0.129370D+01 -0.190364D-01  0.400864D+01
      3  -0.189405D+01  0.676177D-01 -0.118963D+01 -0.371332D+01  0.129992D+01
               121           122           123           124           125 
      1  -0.141386D+01 -0.597521D+00 -0.113924D+01  0.995703D+00  0.283673D+01
      2   0.343164D+00  0.927777D-01 -0.105393D+01  0.242684D+01 -0.543211D+00
      3  -0.266235D+01 -0.969693D+00  0.205973D+01  0.215859D+01  0.245799D+01
               126           127           128           129           130 
      1  -0.370039D+01  0.283845D+01 -0.243029D-01  0.330642D+01 -0.242631D+01
      2  -0.156978D+02  0.866917D+01 -0.233465D+01  0.617285D+01 -0.309089D+01
      3  -0.363960D+00  0.216595D+02 -0.129783D+02 -0.164886D+01 -0.200977D+01
               131           132           133           134           135 
      1   0.960399D+01 -0.160091D+00 -0.121859D+00  0.478100D+01 -0.107919D+02
      2   0.733042D+01  0.132112D+00 -0.635295D+00  0.318999D+01 -0.171047D+02
      3  -0.185889D+02 -0.814155D+01 -0.114210D+01 -0.803870D+01 -0.480405D+01
               136           137           138           139           140 
      1   0.238487D+01  0.565651D+00 -0.257247D+01  0.756188D+00  0.742524D+00
      2  -0.486313D+01 -0.188689D+01  0.605532D+01 -0.180365D+01 -0.189606D+01
      3   0.489919D+01 -0.415673D+01 -0.986914D+00  0.684694D+00 -0.215098D+01
               141           142           143           144           145 
      1  -0.153035D+01 -0.279718D+01  0.113841D+00  0.121955D+01 -0.109123D+01
      2   0.197276D+01  0.422003D+01  0.196010D+01 -0.272815D+01  0.170944D+01
      3   0.121203D+01 -0.232014D+01  0.306196D+01  0.823711D+00 -0.328969D+00
               146           147           148           149           150 
      1   0.215754D+00 -0.135363D+01  0.246995D+00 -0.129228D+01 -0.340734D+00
      2  -0.286556D+00  0.310523D+01 -0.894154D+00  0.111323D+01 -0.919921D+00
      3  -0.176159D+00  0.133660D+01  0.195592D+01  0.223692D+01 -0.152286D+01
               151           152           153           154           155 
      1  -0.378439D+01  0.277489D+01 -0.874051D+01  0.204702D+01  0.397119D+00
      2   0.313066D+01  0.161143D+01  0.166721D+02  0.478599D+00 -0.346788D+00
      3   0.374803D+01 -0.558377D+01  0.207219D+01  0.458470D+01  0.330404D+00
               156           157           158           159           160 
      1  -0.966885D+00  0.165170D+01  0.392239D+01 -0.691329D+01 -0.396553D+01
      2   0.140526D+01 -0.214448D-01 -0.209578D+01  0.215034D+01 -0.265290D+00
      3  -0.226545D+01  0.175099D+01 -0.329162D+00  0.628070D+00 -0.681515D+01
               161           162           163           164           165 
      1  -0.950168D+01  0.148041D+02 -0.105776D+01  0.686492D+00  0.509924D+00
      2   0.432207D+01 -0.541750D+01  0.186399D+00 -0.350588D+00  0.660710D+00
      3  -0.566654D+00 -0.765366D+00 -0.107114D+01 -0.375428D+00  0.165970D+01
               166           167           168           169           170 
      1  -0.183647D+01 -0.813002D+01 -0.771834D+01 -0.183499D+01 -0.833524D+01
      2  -0.281186D+00  0.238522D+01  0.169821D+01 -0.577673D+00  0.254053D+01
      3   0.496558D+01 -0.469505D+01 -0.225086D+01  0.432508D+01 -0.419844D+01
               171           172           173           174           175 
      1  -0.657517D+01  0.797916D+00 -0.526978D+00 -0.189232D+01 -0.678656D-01
      2   0.131893D+01  0.216184D+01  0.546102D+00 -0.251671D+01  0.303156D+00
      3  -0.219477D+01 -0.288178D+00  0.157542D+01 -0.162442D+01  0.119912D+01
               176           177           178           179           180 
      1   0.107811D+01 -0.116946D+01  0.460541D+00  0.138977D+01  0.137902D+02
      2   0.134398D+01 -0.239033D+00 -0.241221D+01 -0.318519D+01  0.196558D+02
      3   0.167571D+01 -0.142850D+01 -0.149186D+01 -0.366087D+01  0.373014D+01
               181           182           183           184           185 
      1  -0.174185D+00  0.137610D+00  0.207007D+01  0.248980D+00 -0.688919D+00
      2  -0.414308D+01 -0.614775D-01  0.635032D+01  0.217357D+00 -0.986434D+00
      3  -0.183597D+02 -0.467671D+01  0.103215D+01 -0.187537D+01  0.620090D-01
               186           187           188           189           190 
      1  -0.459255D+00  0.143422D+01  0.314376D+00  0.253612D+00 -0.996031D+00
      2   0.546908D+00  0.212893D+01 -0.410838D+00  0.244713D+00 -0.128601D+01
      3   0.109992D+01  0.167620D+01  0.190479D+01 -0.935249D+00  0.393158D+01
               191           192           193           194           195 
      1  -0.518508D+00 -0.176554D+01 -0.521156D+00 -0.560848D+01 -0.598283D+01
      2   0.336595D-01 -0.574292D+00 -0.518166D+00 -0.337046D+01 -0.309889D+01
      3   0.485389D+01  0.171496D+01  0.553966D+01  0.238017D+02  0.530273D+01
               196           197           198 
      1  -0.364695D+00 -0.233024D+01 -0.175574D+01
      2  -0.128397D+01 -0.287340D+01 -0.104908D+01
      3   0.221771D+01  0.719934D+01  0.436872D+01
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1   0.778329D+00 -0.251416D+02 -0.169004D+01  0.305337D+02  0.629572D+01
      2  -0.517346D+01  0.176380D+02 -0.733426D+00 -0.313845D+02 -0.122078D+02
      3   0.439513D+01  0.750354D+01  0.242346D+01  0.850768D+00  0.591204D+01
      4  -0.202719D+02  0.640135D+01  0.547698D+01  0.675836D+01 -0.146127D+02
      5   0.146808D+01  0.601846D+01  0.790916D+01  0.605136D+00 -0.301835D+01
      6   0.507313D+01  0.229467D+01  0.114031D+02 -0.321065D+01  0.629504D+00
                 6             7             8             9            10 
      1   0.917125D+00  0.681811D+01  0.675715D+01  0.198845D+01 -0.967240D+01
      2   0.684774D+00 -0.491201D+01 -0.580369D+01 -0.868111D+01  0.405954D+01
      3  -0.160190D+01 -0.190609D+01 -0.953458D+00  0.669266D+01  0.561286D+01
      4  -0.421053D+01  0.476434D+01 -0.245161D+01  0.176568D+02  0.501571D+01
      5   0.179733D+02  0.251098D+02  0.194352D+02  0.269832D+01  0.106691D+02
      6   0.573708D+01  0.111052D+02  0.166016D+02 -0.241701D+01 -0.102173D+01
                11            12            13            14            15 
      1   0.347181D+01  0.758832D+01 -0.137495D+02 -0.250043D+02 -0.238900D+01
      2  -0.124356D+01 -0.382954D+01  0.119510D+02  0.256915D+02  0.412839D+01
      3  -0.222825D+01 -0.375878D+01  0.179850D+01 -0.687246D+00 -0.173939D+01
      4   0.258422D+02 -0.118516D+01 -0.291689D+02  0.834634D+01  0.322396D+01
      5  -0.183220D+01  0.218056D+02 -0.683412D+01  0.237618D+01 -0.435621D+01
      6  -0.114286D+01 -0.238976D+01  0.260743D+01 -0.119100D+01 -0.788359D+01
                16            17            18            19            20 
      1   0.111283D+02 -0.402692D+01  0.158105D+02  0.125332D+02  0.204653D+02
      2  -0.387928D+01  0.268968D+01 -0.218025D+02 -0.115170D+02 -0.139601D+02
      3  -0.724906D+01  0.133724D+01  0.599200D+01 -0.101618D+01 -0.650528D+01
      4  -0.673593D+01 -0.114405D+01 -0.242257D+01  0.106233D+02 -0.132172D+02
      5   0.387231D+02 -0.414217D+01 -0.718469D+01  0.170107D+01 -0.389231D+01
      6  -0.305019D+00  0.521447D+01 -0.169821D+01 -0.205916D+01  0.576192D+01
                21            22            23            24            25 
      1  -0.109820D+01 -0.238938D+02  0.130882D+02  0.109560D+01  0.314339D+00
      2   0.425925D+00  0.233116D+02 -0.224742D+02 -0.444233D+01  0.177680D+01
      3   0.672280D+00  0.582189D+00  0.938607D+01  0.334673D+01 -0.209114D+01
      4  -0.333270D+01  0.993473D+01  0.406394D+01  0.270573D+01 -0.412130D+01
      5  -0.446937D+01 -0.960939D+00  0.318759D+01 -0.144598D+02  0.119381D+02
      6  -0.906901D-01  0.201094D+01 -0.540744D+01  0.850915D+01 -0.768514D+01
                26            27            28            29            30 
      1  -0.187038D+01 -0.436748D+01 -0.809015D+01 -0.267342D+02 -0.247682D+00
      2  -0.311400D+01 -0.594268D+01  0.721183D+01  0.194518D+02 -0.170723D+01
      3   0.498438D+01  0.103102D+02  0.878325D+00  0.728236D+01  0.195491D+01
      4   0.644543D+01 -0.170014D+02 -0.758010D+01 -0.984374D+01 -0.102999D+01
      5  -0.164779D+02 -0.196143D+01 -0.194811D+01 -0.353667D+00 -0.701483D+00
      6   0.136461D+02  0.248638D+01 -0.118520D+01 -0.456746D+01  0.307234D+01
                31            32            33            34            35 
      1  -0.123260D+02 -0.123613D+02 -0.101567D+01  0.195424D+01  0.237599D+00
      2   0.116592D+01  0.121950D+02  0.358637D+00 -0.261531D+01 -0.396579D+00
      3   0.111601D+02  0.166278D+00  0.657036D+00  0.661072D+00  0.158980D+00
      4   0.548701D+01 -0.750798D+01 -0.252118D+01 -0.175786D+01  0.219988D+01
      5  -0.422785D+01 -0.258797D+01  0.241080D+00  0.157634D+01 -0.345576D+01
      6  -0.833708D+01 -0.224233D+01  0.350255D+01  0.225900D+01  0.107421D+02
                36            37            38            39            40 
      1  -0.125604D+02 -0.236719D+02  0.485329D+01 -0.101738D+01 -0.216662D+01
      2   0.288144D+01  0.732245D+01 -0.432646D+00  0.991986D+00  0.478609D+01
      3   0.967895D+01  0.163494D+02 -0.442064D+01  0.253950D-01 -0.261947D+01
      4  -0.184176D+01 -0.668300D+01  0.904231D+01  0.716822D+00 -0.690135D+01
      5   0.208058D+01 -0.996436D+01 -0.495135D+00  0.307487D+01  0.123674D+01
      6  -0.120012D+01  0.315981D+00 -0.219377D+01 -0.165179D+01  0.549452D+01
                41            42            43            44            45 
      1   0.472765D-01  0.991737D+00  0.478169D+01 -0.230107D+01 -0.802327D+01
      2   0.866134D+01  0.123076D+01 -0.114626D+01  0.222533D+01 -0.278656D+01
      3  -0.870862D+01 -0.222250D+01 -0.363543D+01  0.757370D-01  0.108098D+02
      4   0.602213D+01  0.335074D+01 -0.175193D+01  0.405704D+01 -0.118245D+01
      5   0.225746D+01 -0.148953D+00  0.407710D+01  0.153915D+01  0.270558D+00
      6   0.122056D+01 -0.234389D+00 -0.983742D+00  0.505404D+01  0.107975D+01
                46            47            48            49            50 
      1   0.630636D+01  0.103553D+02 -0.718345D+00  0.184966D+01  0.721943D+01
      2  -0.366080D+01 -0.988937D+01  0.170228D+01  0.682348D+01 -0.153736D+02
      3  -0.264556D+01 -0.465899D+00 -0.983939D+00 -0.867314D+01  0.815418D+01
      4   0.894247D+01 -0.212367D+02 -0.202894D+01  0.160475D+02  0.130829D+02
      5   0.571963D+00 -0.209898D+01 -0.696723D+01  0.212583D+01  0.104561D+01
      6  -0.358620D+01  0.263064D+01 -0.990935D+01  0.847901D+00 -0.494963D+01
                51            52            53            54            55 
      1   0.222038D+01 -0.407944D+00  0.794192D-01 -0.172230D+02  0.192501D+02
      2  -0.385258D+01  0.198338D+01 -0.366075D+01  0.433633D+01 -0.454046D+01
      3   0.163220D+01 -0.157543D+01  0.358133D+01  0.128867D+02 -0.147096D+02
      4   0.557229D+00  0.345851D+01  0.464429D+01  0.707477D+01  0.136545D+02
      5   0.160008D+01  0.108791D+01  0.750522D+01  0.531324D+01  0.642400D+01
      6   0.813980D+01 -0.266100D+01  0.175499D+02  0.551550D+01  0.474728D-01
                56            57            58            59            60 
      1   0.121162D+01 -0.933642D+00  0.550359D+01 -0.905889D+01  0.166004D+01
      2   0.239148D+01 -0.460187D+01 -0.418002D+00  0.384229D+00  0.944626D+00
      3  -0.360310D+01  0.553551D+01 -0.508558D+01  0.867466D+01 -0.260467D+01
      4  -0.134009D+02  0.527098D+00 -0.255947D+02 -0.562815D+01 -0.859276D+01
      5   0.165548D+01 -0.125168D+02  0.246808D+01 -0.868844D+01  0.428242D+01
      6  -0.399728D+01  0.388034D+01 -0.671210D+01  0.330714D+01 -0.294657D+01
                61            62            63            64            65 
      1  -0.137957D+02  0.267822D+01  0.378505D+01 -0.187670D+02 -0.199405D+02
      2  -0.127279D+02  0.393610D+01  0.126687D+02  0.324717D+01  0.109363D+02
      3   0.265236D+02 -0.661432D+01 -0.164538D+02  0.155199D+02  0.900418D+01
      4   0.947724D+00 -0.138955D+02  0.559943D+01 -0.245533D+02 -0.671777D+01
      5  -0.187589D+02  0.350120D+01  0.399290D+02  0.156193D+02  0.569378D+01
      6   0.651068D+01 -0.591450D-01 -0.915704D+01  0.680056D+01  0.337512D+01
                66            67            68            69            70 
      1   0.933158D+01 -0.209720D+02  0.839767D+00  0.179901D+01  0.164290D+02
      2  -0.171178D+01  0.110424D+02  0.196539D+01  0.881169D+00  0.477247D-01
      3  -0.761981D+01  0.992962D+01 -0.280516D+01 -0.268018D+01 -0.164767D+02
      4   0.684016D+01 -0.381575D+01  0.128107D+02  0.718696D+01  0.148971D+02
      5  -0.824681D+01  0.709868D+01  0.603778D+01  0.157387D+01 -0.154938D+02
      6  -0.336755D+01  0.469370D+01  0.648388D+01  0.173435D+01 -0.759347D+01
                71            72            73            74            75 
      1   0.793160D+01 -0.987807D+01 -0.558512D+01  0.121044D+02 -0.470140D+01
      2  -0.265862D+01  0.171556D+02  0.884361D+01 -0.723310D+01  0.496478D+01
      3  -0.527298D+01 -0.727751D+01 -0.325849D+01 -0.487129D+01 -0.263372D+00
      4   0.981179D+01 -0.755194D+01  0.420100D+01  0.391351D+01  0.327757D+00
      5  -0.312591D+01 -0.291861D+02 -0.134785D+01  0.123630D+01 -0.192069D+01
      6   0.387710D+01 -0.105091D+02  0.172051D+01  0.721537D+01 -0.108287D+01
                76            77            78            79            80 
      1   0.266996D+02  0.333349D+02 -0.365015D+00 -0.112786D+02 -0.313245D+01
      2  -0.202220D+02 -0.354584D+02 -0.811754D+01  0.742889D+01 -0.853446D+01
      3  -0.647759D+01  0.212355D+01  0.848255D+01  0.384975D+01  0.116669D+02
      4   0.187627D+01 -0.716981D+01  0.492215D+00  0.727115D+00  0.363145D+01
      5   0.313759D+01  0.142852D+01 -0.714471D+01 -0.229271D+01 -0.111180D+02
      6   0.596298D+01 -0.512599D+01 -0.226718D+02 -0.129538D+02 -0.440279D+02
                81            82            83            84            85 
      1   0.300270D+02  0.259099D+02  0.162522D+02 -0.364997D+00  0.103390D+02
      2  -0.287344D+02 -0.449539D+01  0.944572D+00  0.146381D+00  0.816234D+01
      3  -0.129264D+01 -0.214145D+02 -0.171967D+02  0.218615D+00 -0.185014D+02
      4  -0.851149D+01  0.391707D+02  0.348369D+02 -0.127884D+01  0.389249D+02
      5   0.852819D+01 -0.625944D+00 -0.789420D+00  0.535979D+01  0.750495D+00
      6   0.181142D+02 -0.133905D+01 -0.133235D+01  0.288328D+01 -0.212804D+00
                86            87            88            89            90 
      1   0.487707D+01  0.866917D-01 -0.211397D+01 -0.159514D+01 -0.236875D-01
      2   0.179530D+02 -0.336637D+00  0.114269D+01  0.124997D+01  0.111039D+01
      3  -0.228301D+02  0.249945D+00  0.971280D+00  0.345168D+00 -0.108670D+01
      4   0.478327D+02  0.444338D-01 -0.182709D+01 -0.695801D+00  0.142118D+01
      5   0.939744D+00  0.403074D+01  0.781593D+00  0.920237D-01 -0.536894D+00
      6  -0.558633D+00  0.506445D+01  0.628837D+00  0.114332D+01 -0.791162D-01
                91            92            93            94            95 
      1   0.102936D+03 -0.101067D+02 -0.946165D+01 -0.990957D+01  0.104783D+02
      2  -0.600762D+02  0.554777D+01  0.653846D+01  0.479554D+01 -0.523997D+01
      3  -0.428595D+02  0.455897D+01  0.292319D+01  0.511403D+01 -0.523831D+01
      4  -0.145833D+02  0.947065D+01  0.145532D+01  0.173553D+02 -0.487838D+01
      5  -0.137280D+02  0.146286D+01  0.102105D+02  0.261244D+01 -0.175493D+01
      6   0.262351D+00 -0.679012D+00 -0.655034D+00 -0.127755D+01  0.284258D+00
                96            97            98            99           100 
      1   0.153038D+01 -0.127417D+02  0.164882D+01  0.268601D+01  0.578807D+01
      2  -0.113299D+01  0.772197D+01 -0.850481D+00 -0.140241D+01  0.247240D+01
      3  -0.397394D+00  0.501972D+01 -0.798337D+00 -0.128360D+01 -0.826047D+01
      4  -0.181707D+01  0.308584D+01 -0.135673D+01 -0.789546D+00 -0.184684D+02
      5  -0.122000D+01  0.257559D+01 -0.170266D-01 -0.199789D+01 -0.213913D+01
      6   0.203074D+01 -0.216379D+00  0.787447D+00  0.474130D+00  0.187748D+01
               101           102           103           104           105 
      1  -0.457200D+01 -0.552183D+00  0.363073D+00 -0.146789D+02 -0.155730D+01
      2  -0.429598D+01 -0.393221D-01 -0.109399D+02  0.358391D+02  0.256944D+01
      3   0.886799D+01  0.591505D+00  0.105768D+02 -0.211602D+02 -0.101215D+01
      4   0.224042D+02  0.282608D+01  0.258911D+02 -0.483908D+02 -0.495701D+01
      5   0.243445D+01  0.357256D+01  0.255513D+01 -0.378814D+01 -0.408364D+01
      6  -0.226630D+01 -0.230797D+01 -0.275702D+01  0.671763D+01  0.705452D+01
               106           107           108           109           110 
      1  -0.699474D+00 -0.110697D+01 -0.154703D+01 -0.422541D+01  0.790741D+01
      2  -0.792988D+00  0.330322D+01  0.258396D+01  0.641415D+01 -0.990992D+01
      3   0.149246D+01 -0.219625D+01 -0.103693D+01 -0.218874D+01  0.200250D+01
      4   0.427581D+01 -0.609912D+01 -0.167612D+01 -0.350747D+01  0.795612D+01
      5   0.127374D+01 -0.105948D+01 -0.897034D+00  0.413061D+00 -0.336845D-01
      6  -0.138664D+01  0.315728D+01  0.134328D+01  0.125139D+01 -0.238303D+01
               111           112           113           114           115 
      1   0.159057D+01  0.651025D+01 -0.379576D+02 -0.425333D+01  0.100417D+01
      2  -0.115748D+01 -0.837972D+01  0.532164D+02  0.439020D+01 -0.128017D+01
      3  -0.433089D+00  0.186947D+01 -0.152588D+02 -0.136873D+00  0.276004D+00
      4   0.323568D+00  0.594692D+01  0.291822D+01  0.499538D+00  0.362459D+00
      5   0.125887D+01 -0.151559D+00  0.180318D+01  0.342603D+00  0.455834D+00
      6  -0.139484D+01 -0.129780D+01  0.801853D+01  0.715093D+01 -0.335116D+00
               116           117           118           119           120 
      1  -0.354309D+01 -0.149815D+01  0.610029D+01 -0.937963D+00 -0.415833D+01
      2   0.454713D+01  0.200563D+01 -0.929605D+01  0.259602D+00  0.616577D+01
      3  -0.100404D+01 -0.507483D+00  0.319576D+01  0.678360D+00 -0.200744D+01
      4  -0.461797D+00 -0.148908D+01 -0.460906D+01  0.757789D+01  0.172511D+01
      5  -0.611339D+00 -0.753966D+00 -0.118839D+02  0.114992D+01  0.165795D+02
      6   0.282603D+01  0.131579D+01  0.206552D+01  0.491599D-01 -0.176443D+01
               121           122           123           124           125 
      1  -0.353215D+00 -0.182756D+01 -0.223035D+00 -0.142000D+01 -0.977387D+00
      2  -0.803613D+00 -0.492347D+00  0.316212D+00  0.146147D+02 -0.114415D+01
      3   0.115683D+01  0.231990D+01 -0.931773D-01 -0.131947D+02  0.212154D+01
      4   0.109385D+02 -0.329497D+01 -0.404454D+01  0.508957D+01 -0.629033D+01
      5   0.121644D+00 -0.392135D+01 -0.150322D+01  0.257632D+02 -0.398031D+01
      6  -0.173637D+01  0.841084D+00  0.846096D+01 -0.445071D+01  0.538800D+01
               126           127           128           129           130 
      1  -0.131350D+02 -0.639340D+02  0.102698D+02  0.432407D+01 -0.342426D+01
      2  -0.239590D+02  0.364500D+02 -0.141639D+02 -0.465244D+01 -0.436113D+01
      3   0.370939D+02  0.274840D+02  0.389412D+01  0.328374D+00  0.778539D+01
      4  -0.409680D+01  0.146013D+02  0.154553D+02 -0.383731D+01  0.230896D+02
      5  -0.412418D+02  0.565678D+01 -0.184723D+01  0.922172D+01 -0.447128D+01
      6   0.914282D+01 -0.726891D+01  0.293486D+01 -0.608207D+01  0.489961D+01
               131           132           133           134           135 
      1   0.248181D+02  0.541593D+01  0.107235D+02  0.262462D+01  0.165450D+02
      2  -0.277989D+02 -0.117933D+02 -0.131176D+01 -0.130488D+02  0.274379D+00
      3   0.298085D+01  0.637733D+01 -0.941179D+01  0.104242D+02 -0.168194D+02
      4   0.376372D+01  0.133722D+02 -0.108138D+02  0.157800D+02 -0.231922D+01
      5   0.158801D+02 -0.142473D+00  0.710678D+01  0.226683D+01 -0.282702D+02
      6  -0.141389D+02  0.268030D+00 -0.421082D+01 -0.174260D+01  0.186787D+02
               136           137           138           139           140 
      1   0.511113D+02  0.149208D+02 -0.953188D+01  0.111662D+02  0.580045D+01
      2  -0.229774D+02 -0.369285D+01  0.424333D+01 -0.113530D+01  0.290993D+01
      3  -0.281339D+02 -0.112280D+02  0.528855D+01 -0.100309D+02 -0.871038D+01
      4   0.361379D+02  0.208854D+02 -0.688512D+01  0.208462D+02  0.141650D+02
      5  -0.142325D+02 -0.463949D+01  0.109567D+02 -0.434025D+01 -0.513189D+01
      6  -0.592849D+01 -0.298959D+01  0.441771D+01 -0.330096D+01 -0.314537D+01
               141           142           143           144           145 
      1  -0.162846D+01 -0.163530D+02 -0.336501D+01  0.731700D+01  0.729758D+01
      2  -0.640687D+00  0.859175D+01  0.870491D-01 -0.622814D+01 -0.629025D+01
      3   0.226914D+01  0.776120D+01  0.327796D+01 -0.108886D+01 -0.100734D+01
      4  -0.563040D+01 -0.132775D+02 -0.998219D+01  0.822778D+01  0.555056D+01
      5   0.339542D+01  0.159476D+02  0.609493D+01 -0.710929D+01  0.822663D+01
      6   0.327966D+01  0.732457D+01  0.407652D+01 -0.357551D+01  0.243041D+01
               146           147           148           149           150 
      1   0.388800D+01  0.466614D+01  0.202050D+00 -0.115475D+01 -0.156247D+01
      2  -0.228738D+01 -0.485751D+01  0.164035D+01 -0.113478D+01  0.229539D+01
      3  -0.160063D+01  0.191373D+00 -0.184240D+01  0.228953D+01 -0.732917D+00
      4   0.261396D+01  0.226692D+01  0.400349D+01 -0.770496D+00  0.360740D+01
      5   0.694172D+00  0.943100D+01 -0.150746D+01  0.340668D+01 -0.259290D+01
      6   0.117699D+01  0.163704D+01  0.131899D+01  0.865931D+00  0.499892D+01
               151           152           153           154           155 
      1   0.836546D+01 -0.215283D+01 -0.141584D+01  0.767251D+00  0.351466D+00
      2  -0.118942D+02  0.156187D+01 -0.193319D+02 -0.145334D+01 -0.176860D+00
      3   0.352875D+01  0.590963D+00  0.207477D+02  0.686091D+00 -0.174606D+00
      4   0.506035D+01  0.785680D+01  0.720600D+01  0.380153D+01  0.768948D+01
      5   0.189793D+02  0.380702D+01  0.356437D+02 -0.235660D+01 -0.398208D+01
      6   0.671623D+01  0.468928D+01  0.157178D+02 -0.630876D+01 -0.232550D+01
               156           157           158           159           160 
      1  -0.336291D+00 -0.603360D+01 -0.251311D+02  0.120322D+02  0.543927D+01
      2  -0.334600D+00  0.709141D+01  0.287260D+02 -0.109683D+02 -0.377879D+01
      3   0.670891D+00 -0.105781D+01 -0.359494D+01 -0.106388D+01 -0.166048D+01
      4  -0.549360D+01  0.585005D+01  0.916229D+01 -0.451909D+01 -0.101225D+02
      5   0.683289D+01 -0.253618D+01 -0.522430D+01  0.468036D+01  0.778106D+01
      6   0.228849D+01 -0.498924D+01 -0.192202D+02  0.186120D+02  0.111424D+02
               161           162           163           164           165 
      1   0.247514D+02 -0.272664D+02 -0.243558D+00  0.442232D+01  0.228416D+01
      2  -0.194861D+02  0.135817D+02  0.227651D+01 -0.517050D+01 -0.189450D+01
      3  -0.526532D+01  0.136848D+02 -0.203295D+01  0.748176D+00 -0.389652D+00
      4  -0.103862D+02  0.815360D+01  0.126881D+01  0.792122D+01  0.365037D+01
      5   0.107901D+02 -0.121605D+02  0.106713D+01  0.184904D+01  0.260265D+01
      6   0.354286D+02 -0.362303D+02  0.451697D+01 -0.144324D+01 -0.808307D+00
               166           167           168           169           170 
      1  -0.362804D+01 -0.374258D+02 -0.111119D+02  0.232229D+00 -0.203320D+02
      2   0.538138D+01  0.540488D+02  0.164959D+02  0.166286D+01  0.270073D+02
      3  -0.175334D+01 -0.166229D+02 -0.538402D+01 -0.189509D+01 -0.667535D+01
      4   0.677523D+01  0.108263D+02  0.321708D+01  0.520072D+01  0.576621D+01
      5   0.164524D+01  0.380080D+01  0.341707D+01  0.369382D+01  0.556518D+01
      6   0.219299D+01  0.223818D+02  0.161437D+02  0.467202D+01  0.265155D+02
               171           172           173           174           175 
      1  -0.164752D+02  0.394889D+01 -0.273826D+01  0.571854D+01  0.981062D+00
      2   0.154509D+02 -0.391752D+01  0.304669D+01 -0.886560D+00 -0.116797D+01
      3   0.102425D+01 -0.313727D-01 -0.308427D+00 -0.483198D+01  0.186911D+00
      4   0.448162D+01 -0.487474D+00 -0.208775D+01 -0.164574D+01 -0.426992D+00
      5   0.217317D+01  0.189884D+01  0.163663D+00 -0.839338D+00  0.886749D+00
      6   0.146387D+02 -0.149718D+01 -0.176060D+01  0.356992D+01 -0.805099D-01
               176           177           178           179           180 
      1  -0.579458D+01  0.217205D+01  0.659904D+01  0.377643D+01 -0.181611D+02
      2   0.440006D+01 -0.242194D+01 -0.394382D+01 -0.260598D+01 -0.935370D+01
      3   0.139453D+01  0.249890D+00 -0.265522D+01 -0.117045D+01  0.275148D+02
      4  -0.150038D+01  0.214630D+01 -0.717126D+01  0.782221D+01 -0.323933D+01
      5   0.173587D+01  0.113370D-01  0.779085D+01 -0.634220D+01  0.335128D+02
      6  -0.198134D+01  0.601843D+01 -0.209356D+01  0.918746D+01 -0.261094D+02
               181           182           183           184           185 
      1   0.895454D+02 -0.924637D+01 -0.345009D+01  0.654037D+01  0.376863D+01
      2  -0.460519D+02  0.130297D+01  0.146653D+01 -0.632732D+01  0.909471D+00
      3  -0.434934D+02  0.794339D+01  0.198356D+01 -0.213047D+00 -0.467810D+01
      4  -0.384712D+02  0.166045D+02  0.734140D+00  0.813061D+01 -0.368925D+01
      5   0.223165D+01 -0.560733D+00  0.105771D+02  0.533592D+00 -0.161480D+01
      6   0.183068D+01  0.976443D+00 -0.419075D+01  0.308129D+00  0.110714D+01
               186           187           188           189           190 
      1  -0.721252D+00 -0.817075D+01 -0.130132D+00  0.589388D+01  0.320322D+01
      2   0.122696D+01  0.446358D+01  0.190549D+01 -0.498898D+01  0.509151D+00
      3  -0.505705D+00  0.370717D+01 -0.177536D+01 -0.904897D+00 -0.371237D+01
      4  -0.171143D+01  0.451496D+01 -0.393873D+01 -0.307848D+01 -0.171128D+01
      5   0.984262D+00  0.117928D+02 -0.196757D+01 -0.489519D+00 -0.147031D+01
      6   0.767212D+00 -0.341565D+01  0.198962D+01 -0.691481D+00  0.200224D+01
               191           192           193           194           195 
      1  -0.833427D+01 -0.224014D+01 -0.559282D+01 -0.278624D+02 -0.602658D+01
      2   0.957597D+01  0.226026D+01  0.170973D+01  0.486588D+02  0.100495D+02
      3  -0.124171D+01 -0.201232D-01  0.388309D+01 -0.207963D+02 -0.402288D+01
      4  -0.576749D+00  0.124629D+01  0.901659D+01 -0.335101D+02 -0.614893D+01
      5  -0.433971D+00 -0.120327D+01 -0.747717D+00 -0.816937D+01 -0.688064D+01
      6   0.665822D+00  0.254316D+01 -0.174267D+00  0.750249D+01  0.879190D+01
               196           197           198 
      1  -0.430892D+01 -0.688475D+01 -0.749687D+01
      2   0.134758D+01  0.118576D+02  0.614354D+01
      3   0.296134D+01 -0.497289D+01  0.135333D+01
      4   0.519459D+01 -0.113130D+02 -0.462099D+01
      5   0.105557D+01 -0.625781D+01 -0.210948D+01
      6  -0.264620D-01  0.948956D+01  0.455946D+01

 ----------------------------------------------------------------------

 Electric dipole moment (input orientation):
 (Debye = 10**-18 statcoulomb cm , SI units = C m)
                  (au)            (Debye)         (10**-30 SI)
   Tot        0.248154D+00      0.630743D+00      0.210393D+01
   x          0.228478D+00      0.580733D+00      0.193712D+01
   y          0.849445D-01      0.215907D+00      0.720189D+00
   z         -0.465018D-01     -0.118196D+00     -0.394258D+00

 Dipole polarizability, Alpha (input orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(0;0):
               (au)            (10**-24 esu)      (10**-40 SI)
   iso        0.111471D+03      0.165183D+02      0.183791D+02
   aniso      0.570471D+02      0.845351D+01      0.940580D+01
   xx         0.137958D+03      0.204432D+02      0.227462D+02
   yx         0.163919D+01      0.242903D+00      0.270266D+00
   yy         0.121490D+03      0.180029D+02      0.200309D+02
   zx        -0.354524D+01     -0.525350D+00     -0.584531D+00
   zy         0.151232D+01      0.224103D+00      0.249348D+00
   zz         0.749665D+02      0.111089D+02      0.123603D+02

 Dipole polarizability, Alpha (input orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(-w;w) w=  532.0nm:
                  (au)         (10**-24 esu)      (10**-40 SI)
   iso        0.121676D+03      0.180305D+02      0.200616D+02
   aniso      0.615784D+02      0.912498D+01      0.101529D+02
   xx         0.150965D+03      0.223706D+02      0.248907D+02
   yx         0.204140D+01      0.302504D+00      0.336581D+00
   yy         0.131534D+03      0.194914D+02      0.216871D+02
   zx        -0.374916D+01     -0.555568D+00     -0.618153D+00
   zy         0.139921D+01      0.207342D+00      0.230699D+00
   zz         0.825280D+02      0.122294D+02      0.136070D+02

 ----------------------------------------------------------------------

 Dipole orientation:
     6         -0.56469655          1.00365449         -4.55743152
     6         -1.20986827         -1.54511696         -4.60129481
     6         -1.30345256         -2.93267351         -2.36616220
     6         -0.73934845         -1.74384953         -0.09972884
     6         -0.09110474          0.81339270         -0.05371423
     6         -0.00390573          2.19672292         -2.27856556
     6          0.40639081          1.68329970          2.62667135
     6          0.80348043         -0.84403721          4.03702730
     6         -0.73210609         -2.81674549          2.54175414
     1         -0.48852925          2.06263104         -6.30614058
     1         -1.63120726         -2.45621651         -6.38386003
     1         -1.79798374         -4.91928057         -2.40719885
     1          0.50546046          4.17909947         -2.25955092
     1         -1.32533153          2.57546650          3.34296304
     6          2.57573924          3.55181208          2.93253577
     1          0.27173336         -0.73516801          6.02457714
     1          2.80931069         -1.33543593          3.95290119
     1         -2.66869843         -2.94366091          3.26328352
     1          0.07298243         -4.71211499          2.64459003
     1          4.32875066          2.75645476          2.18752716
     1          2.87317206          4.01252755          4.92196496
     1          2.20357921          5.31694588          1.93240411

 Electric dipole moment (dipole orientation):
 (Debye = 10**-18 statcoulomb cm , SI units = C m)
                  (au)            (Debye)         (10**-30 SI)
   Tot        0.248154D+00      0.630743D+00      0.210393D+01
   x          0.000000D+00      0.000000D+00      0.000000D+00
   y          0.000000D+00      0.000000D+00      0.000000D+00
   z          0.248154D+00      0.630743D+00      0.210393D+01

 Dipole polarizability, Alpha (dipole orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(0;0):
               (au)            (10**-24 esu)      (10**-40 SI)
   iso        0.111471D+03      0.165183D+02      0.183791D+02
   aniso      0.570471D+02      0.845351D+01      0.940580D+01
   xx         0.805435D+02      0.119353D+02      0.132798D+02
   yx         0.137380D+02      0.203576D+01      0.226508D+01
   yy         0.117992D+03      0.174846D+02      0.194542D+02
   zx         0.986082D+01      0.146122D+01      0.162583D+01
   zy         0.120081D+01      0.177942D+00      0.197987D+00
   zz         0.135879D+03      0.201351D+02      0.224034D+02

 Dipole polarizability, Alpha (dipole orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(-w;w) w=  532.0nm:
                  (au)         (10**-24 esu)      (10**-40 SI)
   iso        0.121676D+03      0.180305D+02      0.200616D+02
   aniso      0.615784D+02      0.912498D+01      0.101529D+02
   xx         0.886123D+02      0.131310D+02      0.146102D+02
   yx         0.146672D+02      0.217345D+01      0.241829D+01
   yy         0.127729D+03      0.189275D+02      0.210596D+02
   zx         0.108074D+02      0.160148D+01      0.178189D+01
   zy         0.153677D+01      0.227726D+00      0.253380D+00
   zz         0.148686D+03      0.220329D+02      0.245150D+02

 ----------------------------------------------------------------------
 1\1\GINC-CPN-F16-32\Freq\RB3LYP\Gen\C10H12\PIERPA\08-Jul-2021\0\\#P B3
 LYP/Gen EmpiricalDispersion=GD3BJ Integral=UltraFineGrid SCF=(NoSymm,M
 axCyc=120) Polar=ROA Guess=Read Geom=Check CPHF=RdFreq\\ROA calculatio
 ns.\\0,1\C,-2.164986,-1.22492,-0.005005\C,-2.64202,0.073409,0.14669\C,
 -1.762079,1.153232,0.130794\C,-0.405452,0.917524,-0.034454\C,0.074285,
 -0.384887,-0.1864\C,-0.802207,-1.459935,-0.173869\C,1.57772,-0.384146,
 -0.367381\C,1.970002,1.020984,0.144037\C,0.731931,1.906712,-0.098518\H
 ,-2.85672,-2.057467,0.013689\H,-3.702276,0.24425,0.283207\H,-2.135971,
 2.162786,0.253773\H,-0.437393,-2.473544,-0.28667\H,1.78987,-0.436688,-
 1.443748\C,2.317593,-1.524644,0.320775\H,2.87317,1.403772,-0.331853\H,
 2.163642,0.958387,1.218672\H,0.772481,2.369953,-1.090624\H,0.637692,2.
 716269,0.626868\H,2.108272,-1.526468,1.392826\H,3.39662,-1.425796,0.18
 4958\H,2.021897,-2.495429,-0.08111\\Version=ES64L-G16RevA.03\State=1-A
 \HF=-388.4843583\RMSD=4.061e-09\RMSF=3.841e-06\ZeroPoint=0.1920584\The
 rmal=0.2003641\Dipole=0.228478,0.0849445,-0.0465018\DipoleDeriv=-0.044
 5121,0.0259601,-0.0107133,0.0950944,0.0385571,0.0000125,-0.0031683,0.0
 095673,-0.1496511,0.0317622,-0.005505,-0.0306018,-0.0777093,-0.0579125
 ,0.02015,-0.0232514,0.0103602,-0.1459145,-0.0148712,-0.1006101,-0.0178
 892,-0.0724145,0.0820454,0.0262812,-0.0127363,0.0387885,-0.1167244,-0.
 0406253,0.1386755,-0.0087303,0.2694627,0.083241,-0.0307233,-0.0325241,
 -0.0599753,-0.0719053,0.1520604,-0.0207145,-0.0312528,-0.1408522,-0.20
 29374,0.0264987,-0.1483051,0.0226858,-0.0566644,-0.0536492,-0.0095887,
 -0.0086306,-0.0303946,0.1011677,0.0235334,0.0048092,0.0083317,-0.11649
 14,0.103403,-0.051312,0.0107282,-0.011916,0.1404013,-0.0246409,0.04991
 34,-0.0199535,0.1683697,0.1444418,0.0647528,-0.04897,0.0573661,-0.0174
 705,-0.037923,-0.0106951,-0.012024,0.1395101,0.039401,-0.0061441,0.002
 1121,-0.0472267,0.080785,0.0196529,0.0326366,0.0438051,0.2051417,-0.02
 3154,-0.0877127,0.007891,-0.0942462,-0.040011,-0.003224,0.0107686,-0.0
 004243,0.1330089,-0.11782,0.022563,0.0284249,0.022533,0.0609128,-0.008
 4901,0.0332288,-0.0099088,0.1302213,0.0400651,0.0435953,0.0092224,0.06
 90126,-0.0928904,-0.0231754,0.0128443,-0.0278375,0.1182512,0.0550156,0
 .0690202,0.0172656,0.0505402,-0.0844365,-0.0201576,0.0123724,-0.018364
 7,0.1153402,-0.0867525,0.0190849,0.0234483,0.0085582,0.0037593,0.00720
 72,0.0509213,-0.0096349,-0.1616426,0.0622857,0.0254501,-0.0239274,-0.0
 083969,0.0312667,0.036784,0.000769,0.0146051,0.0968195,-0.1519902,-0.0
 755928,0.0473852,-0.063677,0.0109797,0.0172292,0.1033427,0.0424288,0.0
 25104,0.02487,0.0092718,-0.0159457,0.0224406,0.0301806,0.0365512,-0.07
 74889,-0.0016447,-0.1436084,-0.0252111,-0.0475806,0.001599,-0.0322788,
 -0.0274139,0.0568843,0.0123588,0.124278,-0.1065071,-0.0023635,0.022071
 9,0.0134901,-0.0021542,-0.0930836,-0.0637067,-0.0094077,-0.1358358,-0.
 0151538,0.0503558,0.0062792,0.0596716,0.0199464,0.0341608,-0.0315048,0
 .0015809,0.0255501,-0.1283515,-0.1976453,0.0315336,0.0110874,-0.023363
 6,0.0500845,0.0147981,0.0246032,0.0162358,0.0565789,0.0549337,-0.07349
 81,-0.0356646,-0.0103245,-0.131386,-0.0420367,-0.0325723,-0.061033,0.0
 242691\Polar=137.9577193,1.6391905,121.4896266,-3.5452376,1.5123199,74
 .9665008\Quadrupole=1.1436345,1.5391261,-2.6827607,0.1346372,-0.801789
 7,0.4405265\PG=C01 [X(C10H12)]\NImag=0\\0.67867758,0.04528976,0.700059
 38,-0.05898510,0.03710250,0.13534438,-0.15042370,0.09504353,0.01795634
 ,0.72583342,0.03068126,-0.30035973,-0.02133743,-0.00937470,0.65143344,
 0.01321165,-0.02911500,-0.06135156,-0.06939334,0.04131182,0.13684649,0
 .05829860,-0.04475767,-0.00967878,-0.20455917,-0.06557493,0.01213076,0
 .66100107,0.00274753,-0.05625007,-0.00493902,-0.12938144,-0.24771953,0
 .00005634,-0.02548691,0.72104520,-0.00520464,-0.00027965,0.00599966,0.
 00702829,-0.00661007,-0.05794342,-0.06207613,0.04870600,0.14036834,-0.
 04020234,0.03555188,0.00688645,-0.04809729,-0.06584687,0.00059406,-0.3
 2092297,0.06777471,0.03419559,0.71530183,0.03423704,-0.02889053,-0.005
 47432,-0.01812617,0.05143757,0.00592059,0.00756435,-0.13633303,-0.0071
 9222,-0.02937893,0.60450165,0.00485928,-0.00511319,-0.00651878,0.00462
 455,0.00877462,0.00565266,0.03033444,-0.01230457,-0.06819667,-0.062186
 48,0.03517114,0.18131945,-0.04679192,-0.01971702,0.00439199,-0.0009807
 0,-0.01140423,-0.00103171,-0.00876896,0.03629263,0.00536287,-0.1374644
 6,0.09151803,0.01221185,0.62635201,-0.06661905,0.04964159,0.01030780,-
 0.00999240,-0.06841312,-0.00368603,0.08221625,0.01432646,-0.00729874,0
 .02019020,-0.26931398,-0.01830229,0.06342382,0.69128716,-0.00051127,0.
 00715651,0.00631022,-0.00217176,-0.00502592,-0.00558878,0.00944014,-0.
 00352149,0.00580006,0.00673773,-0.02402814,-0.07744143,-0.04512181,0.0
 3040254,0.18197148,-0.31571555,0.00129142,0.02926714,-0.01045843,0.083
 51144,0.00784972,-0.05763237,-0.02246321,0.00338096,0.05936262,-0.0434
 6981,-0.00790116,-0.20449340,-0.06899666,0.01177064,0.65475773,0.06523
 868,-0.13267472,-0.01278857,0.03577819,0.01399133,-0.00357485,-0.02011
 812,-0.00829338,0.00154508,0.00253548,-0.05539391,-0.00425217,-0.12651
 838,-0.25433575,-0.00034716,-0.01881359,0.72625448,0.03433557,-0.00621
 465,-0.06161340,0.00451992,-0.00776663,0.00427727,0.00333977,0.0019530
 2,-0.00476668,-0.00408772,-0.00028003,0.00790418,0.00577844,-0.0059256
 6,-0.06515666,-0.05969264,0.04598203,0.14078167,0.00301343,-0.00198274
 ,-0.00001932,-0.00062395,0.00063044,-0.00016462,0.00098635,0.00113084,
 -0.00014761,-0.02686493,0.01801855,0.00794713,-0.17585692,0.00672748,0
 .01575401,-0.01659612,-0.00381127,0.00271537,0.46918275,-0.00234769,-0
 .00443084,0.00004095,0.00020413,-0.00051168,-0.00002792,0.00009067,-0.
 00526240,-0.00143124,0.02815732,-0.00433671,-0.00628312,-0.00473441,-0
 .08527467,-0.00046597,-0.02244740,0.00871908,0.00405653,-0.04454743,0.
 47080588,-0.00025598,-0.00132102,0.00711019,0.00089403,0.00018374,-0.0
 0102512,-0.00052482,-0.00049063,0.00631071,0.00526667,-0.00346119,0.00
 605088,0.01218903,-0.00008377,-0.07499009,-0.00033725,0.00164408,0.001
 19679,-0.02024879,0.00024440,0.54607115,0.00010833,-0.00171170,0.00050
 156,-0.00107957,0.00113177,0.00052046,-0.00172944,-0.00368088,-0.00059
 829,-0.04434205,0.00455127,-0.00422628,-0.02264529,-0.02861202,-0.0106
 2172,-0.00519250,0.00231989,0.00063478,-0.07913085,-0.01862794,-0.0091
 7510,0.55993325,-0.00020592,-0.00050005,-0.00020746,-0.00026976,0.0006
 2276,0.00071638,-0.00240523,-0.00367302,0.00018927,-0.00520633,0.00997
 292,-0.00443826,-0.02223073,-0.01346317,-0.00127151,0.00036522,-0.0000
 0516,-0.00065966,-0.02190875,-0.13407060,-0.02463901,0.05869354,0.4144
 3432,0.00099156,-0.00020051,-0.00016918,0.00057392,0.00092211,0.000097
 90,-0.00009132,0.00045664,0.00117172,0.00486612,-0.00140268,0.00185770
 ,0.00103622,0.00391246,0.00311664,0.00055945,-0.00080358,0.00087838,-0
 .00998703,-0.02706644,-0.09063772,-0.02497543,-0.03537783,0.56959990,0
 .00018964,-0.00069321,-0.00037614,-0.00194541,0.00414137,0.00153870,-0
 .01915273,-0.02158740,0.00175449,-0.13912353,-0.05919503,0.00436389,0.
 00363232,-0.00975876,-0.00044759,-0.00101888,0.00177819,0.00022172,0.0
 0109914,0.00929638,0.00297028,-0.12940704,0.04381469,-0.01429138,0.401
 07960,0.00008364,-0.00158643,-0.00022827,0.00422755,0.00189850,-0.0016
 7809,-0.00000109,0.00982647,0.00039995,-0.04698566,-0.13300288,0.00084
 490,-0.02121598,-0.03881420,0.00177632,0.00329187,-0.00298845,-0.00106
 024,0.01826603,-0.02906999,0.00495029,0.03889768,-0.10220971,0.0099330
 3,-0.00146597,0.56786855,0.00040374,0.00070381,-0.00102654,0.00042626,
 -0.00111715,0.00655826,0.00299685,0.00260513,0.00143202,0.00444573,-0.
 00016784,-0.07291474,-0.00237569,-0.00320211,0.00830009,0.00094605,-0.
 00181122,0.00589267,0.00954506,-0.00840810,0.00013924,-0.01432589,0.00
 781155,-0.08280735,-0.01183197,0.02907933,0.55983712,-0.17130268,-0.13
 542662,0.00586378,0.01045658,0.00980085,-0.00034782,0.00038352,0.00239
 881,0.00100084,-0.00055152,0.00097591,0.00002197,-0.00528235,0.0023595
 6,0.00171800,-0.01522170,-0.02562760,0.00004378,0.00017387,-0.00128961
 ,-0.00021864,-0.00041397,0.00007183,0.00015203,0.00003790,0.00002346,-
 0.00013744,0.17967497,-0.13533459,-0.22205150,0.00173934,-0.02120513,-
 0.01827102,0.00103285,0.00331734,-0.00404339,-0.00123913,0.00114074,-0
 .00013689,-0.00001211,0.00156554,0.00134866,-0.00064436,0.00496191,0.0
 0744530,-0.00012180,0.00024574,0.00022964,-0.00003101,0.00001228,0.000
 01386,0.00003501,-0.00007094,0.00007692,0.00002356,0.14651843,0.234527
 34,0.00602285,0.00183879,-0.03362300,-0.00264446,-0.00263551,0.0012376
 8,0.00110697,-0.00113586,0.00720302,-0.00009561,-0.00017275,-0.0011115
 0,0.00143575,-0.00070826,0.00735826,0.00212798,0.00341286,0.00140274,0
 .00005410,0.00003449,0.00037689,0.00008004,0.00002981,-0.00018533,0.00
 000129,0.00022086,-0.00074160,-0.00704743,-0.00149474,0.02510420,-0.00
 716336,-0.00053596,0.00094174,-0.32300905,0.04235668,0.03689858,-0.015
 68077,0.00557244,0.00240755,-0.00041837,-0.00405752,0.00068766,0.00063
 296,-0.00027326,-0.00018448,0.00141457,0.00210813,0.00086948,0.0000251
 0,-0.00002830,-0.00018554,-0.00018520,-0.00022833,0.00008536,-0.000356
 46,0.00075430,0.00006317,0.00077397,0.00038791,-0.00048221,0.34374085,
 0.03045183,-0.00010806,-0.00362787,0.04223879,-0.06613461,-0.00751661,
 -0.02504116,0.00804438,0.00345301,-0.00323948,-0.00357624,-0.00043342,
 -0.00041257,-0.00135651,0.00000659,0.00120998,-0.00510140,-0.00107624,
 -0.00001356,0.00004837,0.00006780,-0.00018799,-0.00020886,0.00009105,-
 0.00074862,0.00068417,0.00001287,-0.00049422,0.00102086,0.00040312,-0.
 04573031,0.06578719,0.00316314,0.00009590,0.00073722,0.03701500,-0.007
 55313,-0.03795295,0.00000150,-0.00024192,0.00122006,0.00059949,-0.0004
 0239,0.00763000,-0.00042361,-0.00000860,-0.00111210,0.00087322,-0.0011
 3615,0.00727221,0.00005369,0.00010318,-0.00081460,0.00006475,-0.000030
 11,-0.00017858,-0.00007097,-0.00001994,0.00036166,-0.00054247,0.000303
 26,-0.00354744,-0.04061492,0.00852435,0.02980211,-0.00189496,-0.003335
 92,0.00086129,0.01113041,-0.01958214,-0.00260669,-0.09231816,0.0877777
 3,0.01330825,-0.00540109,0.03079042,0.00349631,-0.00535667,-0.00031296
 ,0.00155076,-0.00111716,-0.00064847,-0.00002340,0.00003968,0.00152131,
 -0.00004259,0.00005595,0.00005465,-0.00013520,0.00184743,0.00025080,-0
 .00019699,0.00032166,-0.00100154,-0.00009441,0.00086019,0.00065788,-0.
 00046949,0.09291289,-0.00444459,-0.00159615,-0.00021453,0.01107835,-0.
 01865852,-0.00279680,0.08689865,-0.29455746,-0.03063393,0.00108634,-0.
 00250047,-0.00063569,0.00050997,0.00195318,-0.00055230,-0.00042893,0.0
 0044539,0.00013505,-0.00034028,-0.00015530,0.00005374,0.00012106,-0.00
 003184,-0.00001653,-0.00034679,0.00050132,0.00035936,0.00055984,-0.000
 98951,-0.00016767,-0.00024282,0.00097774,0.00038709,-0.09549937,0.3141
 2819,0.00077517,-0.00035884,0.00758493,-0.00016215,0.00068915,0.001639
 28,0.01355011,-0.03091852,-0.03920189,0.00056963,-0.00411493,0.0028035
 3,0.00123470,-0.00030164,0.00762194,-0.00000048,0.00015474,-0.00076870
 ,0.00006953,0.00005013,-0.00018531,-0.00011721,-0.00033516,-0.00009352
 ,-0.00063489,0.00090278,-0.00320387,0.00003364,0.00000704,0.00021274,-
 0.00054312,0.00028449,-0.00354534,-0.01532398,0.03395362,0.02897226,-0
 .00557999,0.03068455,0.00311528,-0.00544979,-0.00022054,0.00143441,-0.
 00098270,-0.00057609,-0.00002906,-0.00209674,-0.00345096,0.00086140,0.
 01235370,-0.01809844,-0.00227248,-0.08993650,0.08412124,0.01196244,0.0
 0041195,0.00057519,-0.00038192,0.00013079,0.00005689,-0.00008794,0.000
 47777,-0.00081822,-0.00018864,0.00108412,-0.00047647,-0.00054218,-0.00
 044052,0.00144371,0.00016090,0.00009638,0.00006831,-0.00015653,0.09111
 623,-0.00002069,-0.00167840,-0.00024359,0.00087399,0.00205158,-0.00044
 657,-0.00079673,0.00029959,0.00014963,-0.00407095,-0.00126134,-0.00011
 175,0.01030371,-0.01998050,-0.00275376,0.08521518,-0.29791030,-0.02840
 570,0.00146984,0.00042314,0.00038839,0.00007776,-0.00006556,0.00008946
 ,0.00066626,-0.00081579,-0.00025762,0.00039625,0.00080462,0.00025048,-
 0.00010277,-0.00021339,-0.00001870,0.00012336,-0.00008182,0.00007083,-
 0.09314319,0.31806078,0.00083625,-0.00368813,0.00140689,0.00155128,-0.
 00040433,0.00745839,-0.00001191,0.00018645,-0.00070707,0.00051132,-0.0
 0057406,0.00753368,-0.00032105,0.00025602,0.00352801,0.01197856,-0.027
 71652,-0.03879578,-0.00038316,0.00004163,-0.00361235,-0.00031636,0.000
 19980,-0.00005037,0.00026905,0.00004959,-0.00009291,-0.00051032,0.0003
 7083,-0.00360476,0.00005856,-0.00018363,0.00019407,-0.00017349,0.00009
 706,-0.00139462,-0.01386524,0.03123554,0.02830620,-0.00075885,0.000821
 78,-0.00136438,-0.00069060,-0.00039203,0.00019775,0.00010814,0.0001195
 2,-0.00146463,-0.00219505,-0.00078676,-0.00013843,-0.01241579,0.001818
 65,0.03225054,0.00058254,0.00111752,-0.00030886,-0.05383285,0.00282577
 ,0.04991495,0.00102444,-0.00173203,-0.01083812,-0.00002449,-0.00005669
 ,0.00073055,-0.00009102,-0.00003801,-0.00001593,0.00002505,-0.00002341
 ,0.00016664,-0.00013381,0.00008494,0.00011778,0.00005191,-0.00039932,0
 .00077945,0.06416996,0.00062807,-0.00041901,-0.00031491,0.00006075,0.0
 0065976,0.00009698,-0.00056103,-0.00017954,0.00027737,0.00089433,-0.00
 087848,-0.00042912,-0.00007745,0.00113443,0.00221029,-0.00109231,-0.00
 008115,-0.00014029,0.00245533,-0.04637678,-0.01169246,0.00337342,-0.00
 328073,-0.03011755,0.00013318,0.00072683,-0.00023592,-0.00000501,-0.00
 001158,0.00001703,0.00000249,0.00001329,-0.00006046,-0.00001991,0.0000
 0652,-0.00004809,-0.00003391,-0.00010780,0.00010896,-0.00390586,0.0553
 9661,0.00101405,-0.00036017,0.00001870,-0.00013440,0.00057535,-0.00001
 279,-0.00001468,-0.00020331,0.00015107,0.00082645,0.00089323,0.0004577
 0,0.00524526,0.00009250,-0.00262343,-0.00078743,-0.00095904,0.00057020
 ,0.04372995,-0.01095539,-0.27621375,0.00073133,-0.00161807,-0.01158005
 ,-0.00010511,-0.00085124,0.00001558,0.00006860,-0.00000763,0.00000840,
 0.00001382,0.00001812,-0.00007750,0.00005591,-0.00001624,-0.00000510,-
 0.00000602,0.00009621,-0.00029227,-0.05000645,0.01209289,0.30387640,0.
 00034745,0.00043514,0.00053344,-0.00014269,0.00013313,-0.00006991,-0.0
 0014427,0.00123187,0.00125355,-0.00471690,-0.00133590,0.00013613,-0.01
 984560,0.02732942,-0.01583002,0.00099842,0.00047609,-0.00019909,-0.103
 05222,0.03628837,-0.02616963,0.00568216,-0.00420128,0.00601364,-0.0012
 3893,-0.00200559,-0.00162648,0.00002585,-0.00003861,-0.00002655,-0.000
 01534,0.00001686,-0.00005044,-0.00044107,0.00010334,0.00008321,-0.0002
 5337,0.00001590,-0.00017114,0.00302158,-0.00336409,0.00202399,0.542156
 85,0.00018030,-0.00032455,0.00001600,-0.00046139,-0.00007565,-0.000023
 43,0.00063718,0.00036476,0.00008931,-0.00262834,-0.00017965,0.00127836
 ,0.00738555,0.00192749,-0.00282975,-0.00139784,0.00052648,0.00011347,0
 .03490538,-0.13728421,0.03785633,0.01587462,-0.02699529,0.01097890,-0.
 00174140,-0.00402622,-0.00099404,-0.00010382,0.00000463,0.00007170,0.0
 0002655,-0.00002641,0.00001846,-0.00020488,0.00009540,-0.00004317,-0.0
 0057313,-0.00026159,-0.00015865,0.00054236,-0.00142935,0.00132952,0.03
 675850,0.51152109,-0.00010488,0.00005396,-0.00014572,0.00006754,-0.000
 24570,-0.00007177,0.00044419,-0.00031450,-0.00025313,0.00133808,-0.000
 61326,-0.00039345,-0.00045046,-0.00391062,0.00196485,0.00089390,0.0004
 0078,0.00053719,-0.02675068,0.04087145,-0.10115307,0.00672990,-0.00684
 376,0.00487706,-0.00003071,-0.00286562,-0.00096127,0.00005400,0.000025
 04,0.00000756,0.00004396,-0.00001667,0.00002321,0.00016420,-0.00002932
 ,0.00004455,-0.00015008,-0.00019944,0.00010840,-0.01706052,0.02738295,
 -0.01703466,-0.02389754,0.03671724,0.54294347,-0.00025877,-0.00002153,
 0.00003749,-0.00035120,-0.00006921,0.00013776,-0.00032811,-0.00108470,
 -0.00043951,-0.00355913,0.00271567,-0.00031442,-0.00097194,-0.00105930
 ,-0.00031441,-0.00006442,0.00024873,-0.00022489,-0.00446611,-0.0003988
 5,0.00250874,-0.22364985,-0.07492829,0.09628456,-0.01687906,-0.0095266
 1,0.01005777,-0.00003836,-0.00001852,0.00003846,-0.00009643,-0.0000958
 0,0.00006782,0.00001585,0.00003657,-0.00002624,0.00000011,-0.00008405,
 0.00000103,0.00052631,0.00013370,-0.00046692,0.00000492,-0.00031429,-0
 .00027340,0.24373297,-0.00017475,-0.00029043,0.00018037,0.00011931,-0.
 00021275,-0.00018692,0.00059931,0.00111344,0.00007935,0.00237423,-0.00
 308611,0.00028747,-0.00055340,-0.00516592,-0.00163359,-0.00124881,0.00
 087644,-0.00008682,-0.02330032,-0.00827731,0.01364014,-0.07542007,-0.0
 7976364,0.04162527,0.01656825,0.00798099,-0.00875765,-0.00015486,0.000
 01775,0.00007383,0.00006272,0.00009023,-0.00001140,-0.00007218,0.00002
 848,0.00005993,0.00005989,-0.00000091,-0.00005886,0.00062295,0.0016926
 6,0.00004576,-0.00114607,0.00025524,-0.00036965,0.08243642,0.08507264,
 0.00010248,-0.00031850,-0.00002983,-0.00007937,0.00027023,-0.00000160,
 -0.00053647,-0.00036235,0.00025251,-0.00162986,-0.00001109,0.00040429,
 -0.00118560,-0.00219424,0.00003674,-0.00091501,0.00006189,0.00026526,-
 0.01061410,-0.00491950,0.00391606,0.09960383,0.04284147,-0.10208197,-0
 .00608260,-0.00227781,0.00163848,-0.00006444,0.00000539,-0.00001086,-0
 .00002573,-0.00001467,-0.00002573,-0.00000697,0.00000430,0.00000800,0.
 00001444,0.00000274,-0.00000407,-0.00025421,0.00055248,0.00115584,0.00
 003250,0.00032912,-0.00032686,-0.10507937,-0.04498648,0.10742562,0.000
 19086,-0.00018366,-0.00003742,0.00005578,0.00031171,0.00000674,-0.0005
 0603,-0.00026034,0.00041838,0.00084330,0.00088480,-0.00009881,0.000511
 61,0.00005773,0.00002817,-0.00027959,-0.00021617,0.00015343,-0.0010837
 0,0.00059748,-0.00735733,-0.05730196,-0.00024735,-0.03986367,-0.005457
 15,0.00326230,-0.02559555,-0.00000584,-0.00000460,-0.00001191,-0.00002
 235,-0.00001045,-0.00003435,0.00001690,0.00000749,-0.00003851,-0.00000
 557,-0.00000686,-0.00002243,0.00017907,-0.00059876,-0.00055572,0.00053
 987,0.00078852,0.00019187,0.00548724,-0.00117580,0.02653750,0.05891100
 ,0.00013530,-0.00007671,-0.00004199,-0.00000529,0.00002449,0.00001549,
 0.00010336,0.00027245,-0.00017369,-0.00047316,-0.00073783,0.00021202,0
 .00148751,-0.00006337,-0.00038252,-0.00044558,-0.00003477,0.00044981,-
 0.00488571,-0.00231540,-0.03079423,-0.00009782,-0.04515780,0.01583885,
 0.00549878,-0.00403893,0.02052783,-0.00002852,0.00000624,-0.00003181,0
 .00001827,0.00001508,0.00001831,-0.00004195,-0.00000002,-0.00000082,0.
 00001386,0.00003020,-0.00003191,-0.00230947,-0.00479369,-0.00210065,0.
 00010943,0.00194075,-0.00167435,0.00222229,-0.00064115,0.01134695,-0.0
 0461987,0.05593148,-0.00004569,-0.00009141,-0.00000707,-0.00007905,0.0
 0000854,0.00001685,-0.00012998,-0.00007532,-0.00009182,-0.00011682,-0.
 00005473,0.00033760,0.00035082,-0.00012716,0.00023651,-0.00022927,0.00
 000737,0.00004117,-0.00101618,-0.00170869,-0.01356359,-0.04096877,0.01
 571950,-0.29281819,-0.00041670,0.00129869,-0.00421933,-0.00003338,-0.0
 0000888,0.00000365,-0.00002453,-0.00001288,0.00001129,-0.00000978,0.00
 001835,-0.00000686,-0.00000757,-0.00004028,-0.00001837,-0.00144331,-0.
 00220850,0.00049000,-0.00009674,0.00179040,0.00122084,-0.00186685,0.00
 085258,-0.01399548,0.04660259,-0.01508432,0.31843258,-0.00020516,-0.00
 050207,0.00014519,0.00003633,0.00002796,-0.00131649,0.00032739,-0.0008
 3587,-0.00054778,-0.00289772,-0.01276854,0.02392189,-0.00171174,0.0002
 7881,-0.00006591,-0.00030011,-0.00001103,-0.00093504,0.00016180,-0.000
 33234,0.00000064,-0.00101620,0.01054385,-0.02683013,-0.04386748,-0.003
 77849,0.01190903,0.00001659,0.00000428,0.00009725,-0.00007300,-0.00001
 890,0.00000622,-0.00018766,0.00021449,0.00068974,-0.00006390,-0.000139
 21,0.00001415,0.00014778,0.00005820,0.00031040,0.00023130,0.00053284,0
 .00017785,0.00146749,-0.00108291,0.00003375,-0.00373728,0.00422981,-0.
 00089225,0.05164571,-0.00074365,0.00044517,0.00020859,-0.00045522,-0.0
 0127913,-0.00084884,0.00180926,0.00038339,-0.00022854,-0.00436382,-0.0
 1062443,0.01811046,-0.00162462,-0.00136626,-0.00010095,0.00042541,0.00
 020645,-0.00124581,-0.00040455,0.00006258,0.00119813,-0.00033269,-0.00
 613337,0.01560019,-0.00203472,-0.08855710,0.09285304,0.00000065,-0.000
 00421,0.00015756,-0.00005140,-0.00002992,-0.00002294,-0.00002411,0.000
 11658,0.00048630,-0.00002561,-0.00012825,0.00007190,0.00015539,-0.0001
 6555,-0.00041106,0.00023744,-0.00035661,-0.00033574,-0.00040632,0.0011
 4925,-0.00048050,0.00194498,-0.00129447,0.00027106,0.00476997,0.096982
 84,0.00011887,-0.00033751,-0.00009979,0.00042521,0.00061547,0.00013342
 ,-0.00084920,0.00029576,0.00075997,0.00301313,0.00170042,0.00143999,0.
 00092096,-0.00075694,0.00001519,0.00004486,0.00009073,-0.00002699,-0.0
 0071341,0.00042923,0.00044941,-0.00120885,0.00121795,-0.00457446,0.007
 94181,0.09068201,-0.25281965,0.00001636,0.00000978,-0.00005949,0.00004
 512,0.00004150,0.00000559,0.00007815,0.00003155,-0.00031560,0.00001107
 ,0.00002476,0.00002384,-0.00003619,0.00054216,-0.00022485,0.00010644,-
 0.00002527,0.00014700,-0.00042050,-0.00020356,0.00102229,-0.00103798,0
 .00070876,0.00130776,-0.00961606,-0.10346622,0.27438280,-0.00025933,-0
 .00020125,-0.00017214,0.00033897,-0.00005907,0.00046459,0.00138739,0.0
 0009131,0.00025530,0.00382834,-0.01848282,-0.01861601,-0.00353504,-0.0
 0225206,0.00056636,0.00083972,-0.00058337,0.00068550,-0.00473645,0.001
 10188,-0.00164694,-0.00047749,0.01963945,0.01788018,-0.05011857,0.0160
 7893,0.01479765,-0.00000612,0.00003296,-0.00000004,-0.00000305,0.00002
 105,0.00004096,-0.00038464,0.00053533,-0.00013253,-0.00021835,-0.00028
 478,-0.00001061,0.00023227,0.00009427,0.00007594,0.00073393,0.00091962
 ,0.00058730,-0.00082997,0.00031043,0.00020283,0.00170685,-0.00088664,-
 0.00003454,0.00009022,0.00110530,0.00115431,0.05151508,-0.00020591,0.0
 0043026,0.00003113,-0.00037311,-0.00075928,0.00071256,0.00187703,0.000
 88704,0.00043476,0.00111422,-0.01533439,-0.01188586,-0.00207405,-0.001
 84210,-0.00046257,0.00064285,-0.00061479,0.00060062,0.00205188,-0.0012
 4348,0.00046623,0.00007180,-0.01107821,-0.00921292,0.01644968,-0.18370
 706,-0.12843616,-0.00007205,0.00002966,-0.00014187,-0.00003331,-0.0000
 0883,-0.00000498,-0.00055132,0.00035684,-0.00054999,-0.00014720,-0.000
 21852,-0.00000812,0.00008475,-0.00028205,-0.00019222,-0.00025788,-0.00
 044267,-0.00065020,0.00047099,-0.00043225,0.00005831,-0.00042151,0.000
 75503,0.00033187,-0.00115492,0.01057042,0.00844329,-0.01754687,0.20316
 690,-0.00040160,0.00023666,0.00006575,-0.00024937,-0.00036500,0.000022
 78,0.00025572,-0.00011557,0.00054773,-0.00037908,0.00375225,0.00262783
 ,-0.00001082,0.00010229,0.00006895,0.00040759,0.00047973,-0.00002926,-
 0.00122081,0.00149935,0.00071441,-0.00029949,0.00670129,0.00406562,0.0
 1515866,-0.13154614,-0.16644616,-0.00001645,0.00001646,-0.00001257,-0.
 00003156,-0.00002795,-0.00001818,-0.00033919,-0.00001644,-0.00013591,0
 .00001775,0.00003951,-0.00002578,-0.00004871,0.00050345,0.00008864,0.0
 0001592,0.00024275,0.00020172,0.00005158,-0.00031634,0.00002201,0.0002
 0923,0.00019825,0.00145915,0.00267532,-0.02163563,-0.02149371,-0.01579
 458,0.14019539,0.17837913,-0.00018374,0.00000904,0.00013800,0.00002950
 ,-0.00014759,-0.00004079,0.00014801,0.00000539,0.00002235,0.00010925,0
 .00024047,0.00014199,0.00142238,-0.00054362,-0.00078612,0.00005119,-0.
 00016286,0.00020691,0.00205786,0.00065730,-0.01723790,-0.00006733,-0.0
 0081568,0.00028162,0.00009182,-0.00009273,-0.00014379,0.00000116,0.000
 00809,-0.00001309,0.00000279,-0.00000984,-0.00001632,0.00002428,-0.000
 00983,-0.00000869,0.00001407,-0.00005304,-0.00017064,-0.00097031,0.002
 78254,-0.00188468,-0.05778509,-0.00010835,0.05202947,0.00003537,-0.000
 00769,0.00003620,0.00016000,-0.00017513,0.00024638,-0.00005654,-0.0000
 5922,0.00002739,-0.00001968,-0.00003677,0.00001946,0.05896034,0.000042
 74,0.00002447,0.00010476,0.00000630,0.00006404,-0.00002538,-0.00009209
 ,-0.00004592,0.00006835,-0.00001549,-0.00011260,-0.00028721,-0.0011883
 7,0.00103402,-0.00046141,0.00009563,0.00003809,0.00000057,-0.00450145,
 -0.00175414,0.02553052,-0.00024697,0.00169801,0.00192903,0.00007152,0.
 00016304,-0.00023753,0.00000869,-0.00000528,-0.00000187,-0.00000436,-0
 .00000095,-0.00000948,-0.00000211,-0.00000850,0.00002208,0.00006353,-0
 .00003910,-0.00012393,0.00260561,-0.00345476,0.00253457,0.00013347,-0.
 04709866,-0.00416034,0.00004818,0.00004924,-0.00015788,-0.00016056,-0.
 00020126,-0.00087212,-0.00014554,0.00013317,-0.00009383,0.00003291,0.0
 0000679,-0.00004256,-0.00286729,0.04998738,-0.00024410,0.00008725,0.00
 002214,-0.00013411,-0.00021288,-0.00000911,0.00025529,0.00007371,-0.00
 011544,-0.00057621,0.00037130,0.00027277,0.00123086,-0.00056205,0.0008
 0967,-0.00018695,-0.00010626,0.00025220,0.00204263,0.00094239,-0.01712
 417,0.00001540,-0.00109049,0.00051496,0.00000187,-0.00018902,0.0005185
 5,-0.00003468,0.00000101,-0.00001737,-0.00000385,-0.00000683,0.0000086
 4,-0.00002354,0.00001396,-0.00001588,0.00002754,-0.00003065,-0.0001521
 4,-0.00203270,0.00275395,-0.00002945,0.05076255,-0.00292373,-0.2944976
 3,0.00001582,-0.00014986,0.00016065,0.00023870,0.00077651,0.00077726,0
 .00015868,-0.00017891,-0.00004405,-0.00008792,0.00009049,-0.00003625,-
 0.05471759,0.00072354,0.32264413,0.00008780,0.00005128,-0.00000032,-0.
 00011371,0.00008025,-0.00003009,-0.00000036,0.00027504,0.00018213,-0.0
 0075450,-0.00062193,-0.00011650,0.00061012,0.00269424,-0.00215917,0.00
 021164,0.00024753,0.00005203,-0.01577029,-0.00167330,0.00257553,0.0008
 4348,-0.00070041,0.00006077,-0.00009816,0.00009526,-0.00010975,-0.0000
 4766,-0.00001837,0.00001847,-0.00002218,0.00001591,0.00001602,-0.00010
 903,0.00003351,0.00003308,0.00015104,0.00002771,0.00006666,0.00049073,
 -0.00018646,-0.00044833,-0.29883776,-0.02605416,0.03375809,0.00015697,
 0.00065374,-0.00000026,-0.00001689,0.00024674,0.00024429,0.00007213,0.
 00005219,-0.00001642,0.00009039,0.00002041,0.00002170,-0.00524855,-0.0
 0072970,0.00091920,0.32667774,0.00004545,0.00023597,-0.00019449,0.0000
 5562,0.00001712,0.00005396,-0.00012003,-0.00033956,-0.00032641,0.00147
 655,0.00025352,-0.00018092,0.00042647,-0.00398384,0.00297698,-0.000062
 88,-0.00048524,-0.00018923,0.02695496,0.00188342,-0.00376403,0.0000685
 2,0.00146473,-0.00037881,0.00009033,0.00018785,0.00020123,0.00004811,-
 0.00000152,-0.00001149,-0.00000422,0.00002182,0.00003829,0.00013623,-0
 .00003598,-0.00002187,0.00020681,0.00038214,0.00020242,-0.00082220,0.0
 0094044,-0.00036661,-0.02723019,-0.04901806,0.00320920,-0.00016183,-0.
 00018981,0.00020788,-0.00007150,-0.00005888,-0.00026943,-0.00010155,-0
 .00000718,-0.00002397,-0.00009620,0.00000794,-0.00000302,0.00099046,-0
 .00100622,-0.00015561,0.02682019,0.05220673,-0.00008131,0.00001035,0.0
 0005596,-0.00003891,-0.00006327,-0.00002594,0.00010773,0.00029812,0.00
 008195,-0.00102784,0.00003109,0.00028392,-0.00041325,0.00269942,-0.000
 63402,0.00008172,0.00004896,0.00015198,-0.01650846,-0.00221712,0.00141
 901,0.00025891,-0.00043922,0.00043757,-0.00004872,-0.00018256,-0.00020
 790,-0.00002835,-0.00000386,0.00000016,-0.00000918,-0.00000025,-0.0000
 0244,-0.00008684,0.00002477,-0.00000219,0.00018692,-0.00005464,-0.0001
 0137,0.00013265,-0.00086265,0.00044006,0.03453560,0.00347231,-0.052384
 51,0.00014298,0.00011087,0.00008715,0.00022135,0.00003358,-0.00011986,
 -0.00002972,0.00002408,-0.00002088,0.00006353,0.00000026,-0.00000724,0
 .03161745,0.00366772,-0.00280241,-0.03612241,-0.00578832,0.05228973,-0
 .00017334,-0.00010904,-0.00000608,0.00004428,-0.00013557,0.00001627,0.
 00008557,-0.00006098,-0.00006288,0.00016325,0.00017785,-0.00001040,0.0
 0060569,-0.00057762,0.00067036,-0.00019172,0.00054116,-0.00004750,0.00
 486246,0.01511146,0.00746258,-0.00113966,0.00183995,-0.00168518,0.0002
 3227,0.00071522,0.00021033,0.00001101,0.00001155,-0.00000936,0.0000106
 4,-0.00002971,-0.00000679,0.00002265,-0.00002560,-0.00001226,-0.000860
 62,-0.00006836,-0.00010994,0.00055298,-0.00077151,0.00031403,-0.067269
 09,-0.06496383,-0.02776209,0.00006613,0.00052961,-0.00008952,-0.000186
 13,-0.00009623,-0.00003264,-0.00007997,0.00002534,-0.00000508,-0.00017
 448,0.00009129,-0.00004128,0.00122323,0.00684536,0.00237310,-0.0083729
 5,-0.02864910,-0.01295385,0.07056783,0.00033525,0.00040034,-0.00011898
 ,-0.00004194,0.00019444,0.00000948,-0.00015842,0.00013411,0.00002153,-
 0.00008696,-0.00046620,-0.00000930,-0.00116204,0.00072041,-0.00004783,
 -0.00014389,-0.00058400,-0.00011833,-0.00716041,-0.02180858,-0.0099464
 2,0.00372447,-0.00156962,0.00316484,-0.00086579,-0.00109788,-0.0005523
 8,0.00003994,-0.00001059,-0.00000870,0.00000308,0.00006205,0.00003136,
 -0.00001553,0.00000592,0.00001193,0.00026977,0.00071124,0.00012795,-0.
 00033348,0.00088993,0.00036348,-0.06368935,-0.24911694,-0.08643144,-0.
 00014327,-0.00026610,0.00004226,0.00012241,0.00043855,0.00025537,0.000
 21112,-0.00010338,0.00007392,0.00042962,-0.00024725,0.00010126,0.00039
 634,0.00052915,-0.00022779,-0.00132965,-0.00247537,-0.00080963,0.06959
 873,0.27365977,-0.00000002,0.00011285,-0.00007116,0.00000459,-0.000014
 00,0.00004207,-0.00005019,-0.00000808,-0.00002270,0.00024917,0.0001096
 0,0.00000040,-0.00005475,-0.00070493,0.00040788,-0.00013160,-0.0003327
 4,-0.00026643,0.00586272,0.01516977,0.00556502,-0.00230757,0.00152351,
 -0.00144073,0.00011503,0.00076118,0.00074767,0.00000844,-0.00000605,-0
 .00000137,-0.00000989,0.00001412,0.00000878,0.00001769,0.00000061,-0.0
 0001244,-0.00010448,0.00021518,0.00029239,0.00072212,-0.00042856,0.000
 82127,-0.02735944,-0.08730582,-0.08485378,0.00008251,-0.00019444,0.000
 08153,0.00004571,0.00018994,0.00050591,0.00009328,-0.00002617,-0.00000
 778,-0.00027914,0.00017998,-0.00005865,-0.00974762,-0.02810761,-0.0111
 3706,0.00105528,0.00478424,0.00106127,0.03178817,0.09406741,0.08833792
 \\0.00000209,0.00000653,-0.00000126,-0.00000656,0.00000102,0.00000695,
 -0.00000008,0.00000438,-0.00000308,-0.00000277,-0.00000893,-0.00000052
 ,0.00001582,-0.00001351,-0.00000321,0.00000197,-0.00000132,0.00000132,
 -0.00000943,0.00000672,-0.00000219,-0.00000070,-0.00000191,-0.00000399
 ,0.00000129,0.00000718,0.00000078,0.00000044,0.00000020,0.,-0.00000023
 ,0.00000043,-0.00000002,0.,-0.00000045,0.00000041,-0.00000130,0.000000
 30,0.00000111,-0.00000096,0.00000008,0.00000007,0.00000374,0.00000041,
 -0.00000030,0.00000032,-0.00000138,0.00000036,0.00000083,-0.00000040,0
 .00000322,-0.00000112,0.00000002,0.00000043,0.00000134,0.00000050,0.00
 000121,-0.00000137,0.00000138,-0.00000018,-0.00000021,-0.00000099,-0.0
 0000004,-0.00000312,-0.00000027,-0.00000106\\\@


 A MAN THINKING OR WORKING IS ALWAYS ALONE, 
 LET HIM BE WHERE HE WILL.

                                    -- THOREAU
 Job cpu time:       0 days  6 hours  6 minutes 28.1 seconds.
 Elapsed time:       0 days  0 hours 22 minutes 56.9 seconds.
 File lengths (MBytes):  RWF=    368 Int=      0 D2E=      0 Chk=     12 Scr=      2
 Normal termination of Gaussian 16 at Thu Jul  8 18:49:05 2021.
